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type: datablock
references: doi:10.13018/BMSE001332
title: LNnT
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2,bmse001332,101
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2,bmse001332,103
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2,bmse001332,104
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2,bmse001332,105
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2,bmse001332,106
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2,bmse001332,107
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2,bmse001332,111
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bmse001332,1
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bmse001332,BMET001332
type: chem comp
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chem comp.entry id: bmse001332
chem comp.id: BMET001332
chem comp.aromatic: no
chem comp.formal charge: 0
chem comp.formula: C26H45NO21
chem comp.formula mono iso wt 13c: 733.3356
chem comp.formula mono iso wt 13c 15n: 734.3327
chem comp.formula mono iso wt 15n: 708.2454
chem comp.formula mono iso wt nat: 707.2484
chem comp.formula weight: 707.6296
chem comp.image file name: bmse001332.svg
chem comp.inchi code: InChI=1S/C26H45NO21/c1-6(32)27-11-14(35)20(46-25-18(39)15(36)12(33)7(2-28)43-25)10(5-31)45-24(11)48-22-13(34)8(3-29)44-26(19(22)40)47-21-9(4-30)42-23(41)17(38)16(21)37/h7-26,28-31,33-41H,2-5H2,1H3,(H,27,32)/t7-,8-,9-,10-,11-,12+,13+,14-,15+,16-,17-,18-,19-,20-,21-,22+,23+,24+,25+,26+/m1/s1
chem comp.initial date: 2019-09-30Z
chem comp.name: LNnT
chem comp.number atoms all: 93
chem comp.number atoms nh: 48
chem comp.paramagnetic: no
chem comp.provenance: BMRB
chem comp.sf category: chem_comp
chem comp.sf framecode: LNnT
chem comp.struct file format: MOL
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chem comp.type: NON-POLYMER
chem comp.vendor product code: OL05765

C1,BMET001332,bmse001332
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C2,BMET001332,bmse001332
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C3,BMET001332,bmse001332
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C4,BMET001332,bmse001332
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C5,BMET001332,bmse001332
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C6,BMET001332,bmse001332
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C7,BMET001332,bmse001332
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C8,BMET001332,bmse001332
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chem comp atom.pdbx ordinal: 8
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C9,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C9
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 9
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C10,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C10
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 10
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C11,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C11
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 11
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C12,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C12
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 12
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C13,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C13
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 13
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C14,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C14
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 14
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C15,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C15
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 15
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C16,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C16
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 16
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C17,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C17
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 17
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C18,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C18
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 18
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C19,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C19
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 19
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C20,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C20
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 20
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C21,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C21
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 21
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C22,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C22
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 22
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C23,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C23
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 23
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C24,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C24
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 24
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C25,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C25
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 25
chem comp atom.stereo config: N
chem comp atom.type symbol: C

C26,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: C26
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 26
chem comp atom.stereo config: N
chem comp atom.type symbol: C

N27,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: N27
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 27
chem comp atom.stereo config: N
chem comp atom.type symbol: N

O28,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O28
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 28
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O29,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O29
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 29
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O30,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O30
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 30
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O31,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O31
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 31
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O32,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O32
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 32
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O33,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O33
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 33
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O34,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O34
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 34
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O35,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O35
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 35
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O36,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O36
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 36
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O37,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O37
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 37
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O38,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O38
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 38
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O39,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O39
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 39
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O40,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O40
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 40
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O41,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O41
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 41
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O42,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O42
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 42
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O43,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O43
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 43
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O44,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O44
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 44
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O45,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O45
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 45
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O46,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O46
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 46
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O47,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O47
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 47
chem comp atom.stereo config: N
chem comp atom.type symbol: O

O48,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: O48
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 48
chem comp atom.stereo config: N
chem comp atom.type symbol: O

H49,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H49
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 49
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H50,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H50
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 50
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H51,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H51
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 51
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H52,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H52
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 52
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H53,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H53
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 53
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H54,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H54
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 54
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H55,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H55
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 55
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H56,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H56
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 56
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H57,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H57
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 57
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H58,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H58
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 58
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H59,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H59
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 59
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H60,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H60
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 60
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H61,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H61
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 61
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H62,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H62
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 62
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H63,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H63
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 63
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H64,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H64
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 64
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H65,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H65
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 65
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H66,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H66
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 66
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H67,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H67
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 67
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H68,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H68
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 68
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H69,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H69
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 69
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H70,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H70
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 70
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H71,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H71
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 71
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H72,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H72
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 72
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H73,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H73
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 73
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H74,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H74
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 74
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H75,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H75
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 75
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H76,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H76
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 76
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H77,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H77
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 77
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H78,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H78
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 78
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H79,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H79
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 79
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H80,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H80
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 80
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H81,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H81
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 81
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H82,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H82
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 82
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H83,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H83
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 83
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H84,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H84
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 84
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H85,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H85
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 85
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H86,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H86
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 86
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H87,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H87
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 87
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H88,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H88
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 88
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H89,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H89
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 89
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H90,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H90
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 90
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H91,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H91
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 91
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H92,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H92
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 92
chem comp atom.stereo config: N
chem comp atom.type symbol: H

H93,BMET001332,bmse001332
type: chem comp atom
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
chem comp atom.atom id: H93
chem comp atom.comp id: BMET001332
chem comp atom.entry id: bmse001332
chem comp atom.aromatic flag: no
chem comp atom.charge: 0
chem comp atom.pdbx ordinal: 93
chem comp atom.stereo config: N
chem comp atom.type symbol: H

BMET001332,bmse001332,1
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 1
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: H49
chem comp bond.ordinal: 1
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,2
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 2
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: H50
chem comp bond.ordinal: 2
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,3
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 3
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: H51
chem comp bond.ordinal: 3
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,4
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 4
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: H52
chem comp bond.ordinal: 4
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,5
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 5
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: H53
chem comp bond.ordinal: 5
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,6
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 6
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: H54
chem comp bond.ordinal: 6
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,7
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 7
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: H55
chem comp bond.ordinal: 7
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,8
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 8
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: H56
chem comp bond.ordinal: 8
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,9
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 9
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: H57
chem comp bond.ordinal: 9
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,10
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 10
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: H58
chem comp bond.ordinal: 10
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,11
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 11
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: H59
chem comp bond.ordinal: 11
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,12
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 12
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: C1
chem comp bond.ordinal: 12
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,13
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 13
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C7
chem comp bond.atom id 2: C2
chem comp bond.ordinal: 13
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,14
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 14
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C7
chem comp bond.atom id 2: H60
chem comp bond.ordinal: 14
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,15
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 15
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C8
chem comp bond.atom id 2: C3
chem comp bond.ordinal: 15
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,16
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 16
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C8
chem comp bond.atom id 2: H61
chem comp bond.ordinal: 16
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,17
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 17
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C9
chem comp bond.atom id 2: C4
chem comp bond.ordinal: 17
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,18
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 18
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C9
chem comp bond.atom id 2: H62
chem comp bond.ordinal: 18
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,19
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 19
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C10
chem comp bond.atom id 2: C5
chem comp bond.ordinal: 19
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,20
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 20
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C10
chem comp bond.atom id 2: H63
chem comp bond.ordinal: 20
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,21
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 21
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C11
chem comp bond.atom id 2: C14
chem comp bond.ordinal: 21
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,22
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 22
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C11
chem comp bond.atom id 2: C24
chem comp bond.ordinal: 22
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,23
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 23
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C11
chem comp bond.atom id 2: H64
chem comp bond.ordinal: 23
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,24
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 24
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C12
chem comp bond.atom id 2: C7
chem comp bond.ordinal: 24
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,25
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 25
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C12
chem comp bond.atom id 2: H65
chem comp bond.ordinal: 25
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,26
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 26
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C13
chem comp bond.atom id 2: C8
chem comp bond.ordinal: 26
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,27
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 27
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C13
chem comp bond.atom id 2: H66
chem comp bond.ordinal: 27
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,28
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 28
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C14
chem comp bond.atom id 2: H67
chem comp bond.ordinal: 28
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,29
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 29
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C15
chem comp bond.atom id 2: C12
chem comp bond.ordinal: 29
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,30
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 30
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C15
chem comp bond.atom id 2: H68
chem comp bond.ordinal: 30
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,31
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 31
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C16
chem comp bond.atom id 2: C17
chem comp bond.ordinal: 31
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,32
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 32
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C16
chem comp bond.atom id 2: H69
chem comp bond.ordinal: 32
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,33
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 33
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C17
chem comp bond.atom id 2: C23
chem comp bond.ordinal: 33
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,34
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 34
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C17
chem comp bond.atom id 2: H70
chem comp bond.ordinal: 34
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,35
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 35
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C18
chem comp bond.atom id 2: C15
chem comp bond.ordinal: 35
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,36
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 36
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C18
chem comp bond.atom id 2: H71
chem comp bond.ordinal: 36
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,37
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 37
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C19
chem comp bond.atom id 2: C26
chem comp bond.ordinal: 37
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,38
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 38
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C19
chem comp bond.atom id 2: H72
chem comp bond.ordinal: 38
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,39
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 39
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C20
chem comp bond.atom id 2: C10
chem comp bond.ordinal: 39
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,40
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 40
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C20
chem comp bond.atom id 2: C14
chem comp bond.ordinal: 40
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,41
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 41
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C20
chem comp bond.atom id 2: H73
chem comp bond.ordinal: 41
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,42
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 42
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C21
chem comp bond.atom id 2: C9
chem comp bond.ordinal: 42
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,43
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 43
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C21
chem comp bond.atom id 2: C16
chem comp bond.ordinal: 43
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,44
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 44
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C21
chem comp bond.atom id 2: H74
chem comp bond.ordinal: 44
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,45
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 45
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C22
chem comp bond.atom id 2: C13
chem comp bond.ordinal: 45
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,46
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 46
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C22
chem comp bond.atom id 2: C19
chem comp bond.ordinal: 46
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,47
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 47
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C22
chem comp bond.atom id 2: H75
chem comp bond.ordinal: 47
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,48
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 48
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C23
chem comp bond.atom id 2: H76
chem comp bond.ordinal: 48
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,49
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 49
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C24
chem comp bond.atom id 2: H77
chem comp bond.ordinal: 49
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,50
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 50
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C25
chem comp bond.atom id 2: C18
chem comp bond.ordinal: 50
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,51
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 51
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C25
chem comp bond.atom id 2: H78
chem comp bond.ordinal: 51
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,52
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 52
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: C26
chem comp bond.atom id 2: H79
chem comp bond.ordinal: 52
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,53
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 53
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N27
chem comp bond.atom id 2: C6
chem comp bond.ordinal: 53
chem comp bond.stereo config: N
chem comp bond.type: amide
chem comp bond.value order: SING

BMET001332,bmse001332,54
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 54
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N27
chem comp bond.atom id 2: C11
chem comp bond.ordinal: 54
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,55
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 55
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: N27
chem comp bond.atom id 2: H80
chem comp bond.ordinal: 55
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,56
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 56
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O28
chem comp bond.atom id 2: C2
chem comp bond.ordinal: 56
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,57
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 57
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O28
chem comp bond.atom id 2: H81
chem comp bond.ordinal: 57
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,58
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 58
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O29
chem comp bond.atom id 2: C3
chem comp bond.ordinal: 58
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,59
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 59
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O29
chem comp bond.atom id 2: H82
chem comp bond.ordinal: 59
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,60
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 60
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O30
chem comp bond.atom id 2: C4
chem comp bond.ordinal: 60
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,61
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 61
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O30
chem comp bond.atom id 2: H83
chem comp bond.ordinal: 61
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,62
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 62
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O31
chem comp bond.atom id 2: C5
chem comp bond.ordinal: 62
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,63
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 63
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O31
chem comp bond.atom id 2: H84
chem comp bond.ordinal: 63
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,64
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 64
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O32
chem comp bond.atom id 2: C6
chem comp bond.ordinal: 64
chem comp bond.stereo config: N
chem comp bond.value order: DOUB

BMET001332,bmse001332,65
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 65
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O33
chem comp bond.atom id 2: C12
chem comp bond.ordinal: 65
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,66
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 66
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O33
chem comp bond.atom id 2: H85
chem comp bond.ordinal: 66
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,67
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 67
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O34
chem comp bond.atom id 2: C13
chem comp bond.ordinal: 67
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,68
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 68
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O34
chem comp bond.atom id 2: H86
chem comp bond.ordinal: 68
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,69
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 69
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O35
chem comp bond.atom id 2: C14
chem comp bond.ordinal: 69
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,70
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 70
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O35
chem comp bond.atom id 2: H87
chem comp bond.ordinal: 70
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,71
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 71
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O36
chem comp bond.atom id 2: C15
chem comp bond.ordinal: 71
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,72
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 72
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O36
chem comp bond.atom id 2: H88
chem comp bond.ordinal: 72
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,73
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 73
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O37
chem comp bond.atom id 2: C16
chem comp bond.ordinal: 73
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,74
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 74
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O37
chem comp bond.atom id 2: H89
chem comp bond.ordinal: 74
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,75
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 75
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O38
chem comp bond.atom id 2: C17
chem comp bond.ordinal: 75
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,76
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 76
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O38
chem comp bond.atom id 2: H90
chem comp bond.ordinal: 76
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,77
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 77
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O39
chem comp bond.atom id 2: C18
chem comp bond.ordinal: 77
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,78
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 78
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O39
chem comp bond.atom id 2: H91
chem comp bond.ordinal: 78
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,79
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 79
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O40
chem comp bond.atom id 2: C19
chem comp bond.ordinal: 79
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,80
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 80
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O40
chem comp bond.atom id 2: H92
chem comp bond.ordinal: 80
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,81
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 81
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O41
chem comp bond.atom id 2: C23
chem comp bond.ordinal: 81
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,82
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 82
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O41
chem comp bond.atom id 2: H93
chem comp bond.ordinal: 82
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,83
type: chem comp bond
of datablock: info:bmrb.metabolomics/bmse001332
chem comp bond.comp id: BMET001332
chem comp bond.entry id: bmse001332
chem comp bond.id: 83
chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O42
chem comp bond.atom id 2: C9
chem comp bond.ordinal: 83
chem comp bond.stereo config: N
chem comp bond.type: covalent
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BMET001332,bmse001332,84
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chem comp bond.value order: SING

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chem comp bond.aromatic flag: no
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BMET001332,bmse001332,92
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BMET001332,bmse001332,93
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chem comp bond.aromatic flag: no
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chem comp bond.atom id 2: C21
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chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,94
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chem comp bond.aromatic flag: no
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chem comp bond.value order: SING

BMET001332,bmse001332,95
type: chem comp bond
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chem comp bond.entry id: bmse001332
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chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O48
chem comp bond.atom id 2: C22
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chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,96
type: chem comp bond
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chem comp bond.entry id: bmse001332
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chem comp bond.aromatic flag: no
chem comp bond.atom id 1: O48
chem comp bond.atom id 2: C24
chem comp bond.ordinal: 96
chem comp bond.stereo config: N
chem comp bond.type: covalent
chem comp bond.value order: SING

BMET001332,bmse001332,LNnT,name
type: chem comp common name
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chem comp common name.comp id: BMET001332
chem comp common name.entry id: bmse001332
chem comp common name.name: LNnT
chem comp common name.type: name

9831622,BMET001332,PubChem,bmse001332
type: chem comp db link
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chem comp db link.accession code: 9831622
chem comp db link.comp id: BMET001332
chem comp db link.database code: PubChem
chem comp db link.entry id: bmse001332
chem comp db link.accession code type: cid
chem comp db link.author supplied: no
chem comp db link.entry relation type: same molecule

info:pubchem.compound/9831622

pubchem.compound:9831622

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type: chem comp descriptor
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chem comp descriptor.comp id: BMET001332
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chem comp descriptor.entry id: bmse001332
chem comp descriptor.program: na
chem comp descriptor.program version: 2017.09.3
chem comp descriptor.type: SMILES

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type: chem comp descriptor
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chem comp descriptor.comp id: BMET001332
chem comp descriptor.descriptor: CC(=O)NC1C(OC2C(O)C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C2O)OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1O
chem comp descriptor.entry id: bmse001332
chem comp descriptor.program: na
chem comp descriptor.program version: 2017.09.3
chem comp descriptor.type: SMILES_CANONICAL

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type: chem comp descriptor
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chem comp descriptor.descriptor: CC(=O)NC1C(OC2C(O)C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C2O)OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1O
chem comp descriptor.entry id: bmse001332
chem comp descriptor.program: na
chem comp descriptor.program version: 2017.09.3
chem comp descriptor.type: na

BMET001332,IEQCXFNWPAHHQR-ZORDJYFOSA-N,bmse001332,na,2.3.2,na
type: chem comp descriptor
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chem comp descriptor.comp id: BMET001332
chem comp descriptor.descriptor: IEQCXFNWPAHHQR-ZORDJYFOSA-N
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chem comp descriptor.program: na
chem comp descriptor.program version: 2.3.2
chem comp descriptor.type: na

BMET001332,,bmse001332,na,na,INCHI
type: chem comp descriptor
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chem comp descriptor.comp id: BMET001332
chem comp descriptor.descriptor: InChI=1S/C26H45NO21/c1-6(32)27-11-14(35)20(46-25-18(39)15(36)12(33)7(2-28)43-25)10(5-31)45-24(11)48-22-13(34)8(3-29)44-26(19(22)40)47-21-9(4-30)42-23(41)17(38)16(21)37/h7-26,28-31,33-41H,2-5H2,1H3,(H,27,32)/t7-,8-,9-,10-,11-,12+,13+,14-,15+,16-,17-,18-,19-,20-,21-,22+,23+,24+,25+,26+/m1/s1
chem comp descriptor.entry id: bmse001332
chem comp descriptor.program: na
chem comp descriptor.program version: na
chem comp descriptor.type: INCHI

BMET001332,OC[C@H]1O[C@@H](O[C@H]2[C@@H](O)[C@@H](CO)O[C@H]([C@@H]2O)O[C@@H,bmse001332,na,2.3.2,SMILES
type: chem comp descriptor
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chem comp descriptor.comp id: BMET001332
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chem comp descriptor.entry id: bmse001332
chem comp descriptor.program: na
chem comp descriptor.program version: 2.3.2
chem comp descriptor.type: SMILES

BMET001332,OC[C@H]1O[C@@H](O[C@H]2[C@@H](O)[C@@H](CO)O[C@H]([C@@H]2O)O[C@@H,bmse001332,na,2.3.2,SMILES CANONICAL
type: chem comp descriptor
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chem comp descriptor.comp id: BMET001332
chem comp descriptor.descriptor: OC[C@H]1O[C@@H](O[C@H]2[C@@H](O)[C@@H](CO)O[C@H]([C@@H]2O)O[C@@H]2[C@@H](CO)O[C@@H]([C@@H]([C@H]2O)O)O)[C@@H]([C@H]([C@@H]1O[C@@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O)O)O)O)NC(=O)C
chem comp descriptor.entry id: bmse001332
chem comp descriptor.program: na
chem comp descriptor.program version: 2.3.2
chem comp descriptor.type: SMILES_CANONICAL

1,bmse001332,1
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1,bmse001332,2
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1,bmse001332,3
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chem shift experiment.entry id: bmse001332
chem shift experiment.experiment id: 3
chem shift experiment.experiment name: 1D 13C
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1,bmse001332,4
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1,bmse001332,5
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2,bmse001332,14
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2,bmse001332,16
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13,C,1,bmse001332,TMS
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chem shift ref.atom type: C
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chem shift ref.entry id: bmse001332
chem shift ref.mol common name: TMS
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chem shift ref.correction val cit id: 0
chem shift ref.indirect shift ratio: 1.0
chem shift ref.indirect shift ratio cit id: 0
chem shift ref.ref method: internal
chem shift ref.ref type: direct

1,H,1,bmse001332,TMS
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chem shift ref.indirect shift ratio cit id: 0
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chem shift ref.atom type: C
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bmse001332,1
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bmse001332,1
type: citation
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citation.entry id: bmse001332
citation.id: 1
citation.class: entry citation
citation.doi: 10.12018/BMSE001332
citation.sf category: citations
citation.sf framecode: entry_citation
citation.status: published
citation.title: LNnT
citation.type: BMRB only
citation.year: 2019

info:doi/10.12018/BMSE001332

doi:10.12018/BMSE001332

bmse001332,2
type: citation
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reference to entry: entry
citation.entry id: bmse001332
citation.id: 2
citation.class: reference citation
citation.doi: 10.1093/nar/gkl1031
citation.journal abbrev: Nucleic Acids Res.
citation.journal issn: 0305-1048
citation.journal issue: Database issue
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experiment file.content: Peak list
experiment file.details: TopSpin XML
experiment file.directory path: nmr/set02/transitions/1D_1H
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: text/xml

12,2
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 12
experiment file.name: 2
experiment file.content: NMR experiment directory
experiment file.details: 2D 1H-1H TOCSY
experiment file.directory path: nmr/set02
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: text/directory

12,2D 1H-1H TOCSY.png
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 12
experiment file.name: 2D_1H-1H_TOCSY.png
experiment file.content: Spectral image
experiment file.directory path: nmr/set02/spectra/2D_1H-1H_TOCSY
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: image/png

13,1D 13C.png
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 13
experiment file.name: 1D_13C.png
experiment file.content: Spectral image
experiment file.directory path: nmr/set02/spectra/1D_13C
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: image/png

13,1D 13C.xml
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 13
experiment file.name: 1D_13C.xml
experiment file.content: Peak list
experiment file.details: TopSpin XML
experiment file.directory path: nmr/set02/transitions/1D_13C
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: text/xml

13,3
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 13
experiment file.name: 3
experiment file.content: NMR experiment directory
experiment file.details: 1D 13C
experiment file.directory path: nmr/set02
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: text/directory

14,1D DEPT90.png
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 14
experiment file.name: 1D_DEPT90.png
experiment file.content: Spectral image
experiment file.directory path: nmr/set02/spectra/1D_DEPT90
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: image/png

14,1D DEPT90.xml
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 14
experiment file.name: 1D_DEPT90.xml
experiment file.content: Peak list
experiment file.details: TopSpin XML
experiment file.directory path: nmr/set02/transitions/1D_DEPT90
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: text/xml

14,4
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 14
experiment file.name: 4
experiment file.content: NMR experiment directory
experiment file.details: 1D DEPT90
experiment file.directory path: nmr/set02
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: text/directory

15,1D DEPT135.png
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 15
experiment file.name: 1D_DEPT135.png
experiment file.content: Spectral image
experiment file.directory path: nmr/set02/spectra/1D_DEPT135
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: image/png

15,1D DEPT135.xml
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 15
experiment file.name: 1D_DEPT135.xml
experiment file.content: Peak list
experiment file.details: TopSpin XML
experiment file.directory path: nmr/set02/transitions/1D_DEPT135
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: text/xml

15,5
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 15
experiment file.name: 5
experiment file.content: NMR experiment directory
experiment file.details: 1D DEPT135
experiment file.directory path: nmr/set02
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: text/directory

16,2D 1H-13C HSQC.png
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 16
experiment file.name: 2D_1H-13C_HSQC.png
experiment file.content: Spectral image
experiment file.directory path: nmr/set02/spectra/2D_1H-13C_HSQC
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: image/png

16,2D 1H-13C HSQC.xml
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 16
experiment file.name: 2D_1H-13C_HSQC.xml
experiment file.content: Peak list
experiment file.details: TopSpin XML
experiment file.directory path: nmr/set02/transitions/2D_1H-13C_HSQC
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: text/xml

16,6
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 16
experiment file.name: 6
experiment file.content: NMR experiment directory
experiment file.details: 2D 1H-13C HSQC
experiment file.directory path: nmr/set02
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: text/directory

17,7
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 17
experiment file.name: 7
experiment file.content: NMR experiment directory
experiment file.details: 2D 1H-13C HSQC SW small
experiment file.directory path: nmr/set02
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: text/directory

18,2D 1H-13C HMBC.png
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 18
experiment file.name: 2D_1H-13C_HMBC.png
experiment file.content: Spectral image
experiment file.directory path: nmr/set02/spectra/2D_1H-13C_HMBC
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: image/png

18,8
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 18
experiment file.name: 8
experiment file.content: NMR experiment directory
experiment file.details: 2D 1H-13C HMBC
experiment file.directory path: nmr/set02
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: text/directory

19,2D 1H-1H COSY.png
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 19
experiment file.name: 2D_1H-1H_COSY.png
experiment file.content: Spectral image
experiment file.directory path: nmr/set02/spectra/2D_1H-1H_COSY
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: image/png

19,9
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 19
experiment file.name: 9
experiment file.content: NMR experiment directory
experiment file.details: 2D 1H-1H COSY
experiment file.directory path: nmr/set02
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: text/directory

20,10
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 20
experiment file.name: 10
experiment file.content: NMR experiment directory
experiment file.details: 2D 1H-13C HSQC-TOCSY-ADIA
experiment file.directory path: nmr/set02
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: text/directory

20,2D 1H-13C HSQC-TOCSY-ADIA.png
type: experiment file
of datablock: info:bmrb.metabolomics/bmse001332
experiment file.experiment id: 20
experiment file.name: 2D_1H-13C_HSQC-TOCSY-ADIA.png
experiment file.content: Spectral image
experiment file.directory path: nmr/set02/spectra/2D_1H-13C_HSQC-TOCSY-ADIA
experiment file.entry id: bmse001332
experiment file.experiment list id: 1
experiment file.type: image/png

bmse001332,1
type: experiment list
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
experiment list.entry id: bmse001332
experiment list.id: 1
experiment list.sf category: experiment_list
experiment list.sf framecode: experiment_list

bmse001332,1
type: nmr spectrometer
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
nmr spectrometer.entry id: bmse001332
nmr spectrometer.id: 1
nmr spectrometer.details: equipped with SampleJet automated sample changer
nmr spectrometer.field strength: 500
nmr spectrometer.manufacturer: Bruker
nmr spectrometer.model: Avance III
nmr spectrometer.sf category: NMR_spectrometer
nmr spectrometer.sf framecode: spectrometer_kerry

bmse001332,1
type: release
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
release.entry id: bmse001332
release.release number: 1
release.author: BMRB
release.date: 2019-09-30Z
release.type: original

bmse001332,1
type: sample
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
sample.entry id: bmse001332
sample.id: 1
sample.crystal grow method cit id: 0
sample.crystal grow seeding cit id: 0
sample.sf category: sample
sample.sf framecode: sample_1
sample.type: solution

bmse001332,2
type: sample
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
sample.entry id: bmse001332
sample.id: 2
sample.crystal grow method cit id: 0
sample.crystal grow seeding cit id: 0
sample.sf category: sample
sample.sf framecode: sample_2
sample.type: solution

bmse001332,1,1
type: sample component
of datablock: info:bmrb.metabolomics/bmse001332
sample component.entry id: bmse001332
sample component.id: 1
sample component.sample id: 1
sample component.assembly id: 1
sample component.assembly label: assembly_1
sample component.concentration val: 10
sample component.concentration val units: mg
sample component.entity id: 1
sample component.entity label: entity_1
sample component.isotopic labeling: natural abundance
sample component.mol common name: LNnT
sample component.type: solute
sample component.vendor: Carbosynth
sample component.vendor product code: OL05765
sample component.vendor product name: LNnT

bmse001332,2,1
type: sample component
of datablock: info:bmrb.metabolomics/bmse001332
sample component.entry id: bmse001332
sample component.id: 2
sample component.sample id: 1
sample component.assembly id: 1
sample component.assembly label: assembly_1
sample component.concentration val: 100.0
sample component.concentration val units: %
sample component.entity id: 1
sample component.entity label: entity_1
sample component.mol common name: D2O
sample component.type: solvent

bmse001332,3,1
type: sample component
of datablock: info:bmrb.metabolomics/bmse001332
sample component.entry id: bmse001332
sample component.id: 3
sample component.sample id: 1
sample component.assembly id: 1
sample component.assembly label: assembly_1
sample component.concentration val: 0.01
sample component.concentration val units: mg/mL
sample component.entity id: 1
sample component.entity label: entity_1
sample component.mol common name: DSS
sample component.type: reference

bmse001332,4,1
type: sample component
of datablock: info:bmrb.metabolomics/bmse001332
sample component.entry id: bmse001332
sample component.id: 4
sample component.sample id: 1
sample component.assembly id: 1
sample component.assembly label: assembly_1
sample component.concentration val: 50
sample component.concentration val units: mM
sample component.entity id: 1
sample component.entity label: entity_1
sample component.mol common name: sodium phosphate
sample component.type: buffer

bmse001332,5,1
type: sample component
of datablock: info:bmrb.metabolomics/bmse001332
sample component.entry id: bmse001332
sample component.id: 5
sample component.sample id: 1
sample component.assembly id: 1
sample component.assembly label: assembly_1
sample component.concentration val: 500
sample component.concentration val units: uM
sample component.entity id: 1
sample component.entity label: entity_1
sample component.mol common name: sodium azide
sample component.type: cytocide

bmse001332,6,2
type: sample component
of datablock: info:bmrb.metabolomics/bmse001332
sample component.entry id: bmse001332
sample component.id: 6
sample component.sample id: 2
sample component.assembly id: 1
sample component.assembly label: assembly_1
sample component.concentration val: 10
sample component.concentration val units: mg
sample component.entity id: 1
sample component.entity label: entity_1
sample component.isotopic labeling: natural abundance
sample component.mol common name: LNnT
sample component.type: solute
sample component.vendor: Carbosynth
sample component.vendor product code: OL05765
sample component.vendor product name: LNnT

bmse001332,7,2
type: sample component
of datablock: info:bmrb.metabolomics/bmse001332
sample component.entry id: bmse001332
sample component.id: 7
sample component.sample id: 2
sample component.assembly id: 1
sample component.assembly label: assembly_1
sample component.concentration val: 100.0
sample component.concentration val units: %
sample component.entity id: 1
sample component.entity label: entity_1
sample component.mol common name: DMSO
sample component.type: solvent

bmse001332,8,2
type: sample component
of datablock: info:bmrb.metabolomics/bmse001332
sample component.entry id: bmse001332
sample component.id: 8
sample component.sample id: 2
sample component.assembly id: 1
sample component.assembly label: assembly_1
sample component.concentration val: 0.05
sample component.concentration val units: %
sample component.entity id: 1
sample component.entity label: entity_1
sample component.mol common name: TMS
sample component.type: reference

bmse001332,1
type: sample condition list
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
sample condition list.entry id: bmse001332
sample condition list.id: 1
sample condition list.sf category: sample_conditions
sample condition list.sf framecode: sample_conditions_1

bmse001332,2
type: sample condition list
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
sample condition list.entry id: bmse001332
sample condition list.id: 2
sample condition list.sf category: sample_conditions
sample condition list.sf framecode: sample_conditions_2

bmse001332,1,pressure
type: sample condition variable
of datablock: info:bmrb.metabolomics/bmse001332
sample condition variable.entry id: bmse001332
sample condition variable.sample condition list id: 1
sample condition variable.type: pressure
sample condition variable.val: 1
sample condition variable.val units: atm

bmse001332,1,temperature
type: sample condition variable
of datablock: info:bmrb.metabolomics/bmse001332
sample condition variable.entry id: bmse001332
sample condition variable.sample condition list id: 1
sample condition variable.type: temperature
sample condition variable.val: 298
sample condition variable.val err: 0.1
sample condition variable.val units: K

bmse001332,2,pD
type: sample condition variable
of datablock: info:bmrb.metabolomics/bmse001332
sample condition variable.entry id: bmse001332
sample condition variable.sample condition list id: 2
sample condition variable.type: pD
sample condition variable.val: 7.4
sample condition variable.val err: 0.37
sample condition variable.val units: pH

bmse001332,2,pressure
type: sample condition variable
of datablock: info:bmrb.metabolomics/bmse001332
sample condition variable.entry id: bmse001332
sample condition variable.sample condition list id: 2
sample condition variable.type: pressure
sample condition variable.val: 1
sample condition variable.val units: atm

bmse001332,2,temperature
type: sample condition variable
of datablock: info:bmrb.metabolomics/bmse001332
sample condition variable.entry id: bmse001332
sample condition variable.sample condition list id: 2
sample condition variable.type: temperature
sample condition variable.val: 298
sample condition variable.val err: 0.1
sample condition variable.val units: K

bmse001332,1
type: software
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
software.entry id: bmse001332
software.id: 1
software.name: ALATIS
software.sf category: software
software.sf framecode: software_alatis

bmse001332,2
type: software
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
software.entry id: bmse001332
software.id: 2
software.name: NMRBot
software.sf category: software
software.sf framecode: software_nmrbot

bmse001332,3
type: software
of datablock: info:bmrb.metabolomics/bmse001332
reference to entry: entry
software.entry id: bmse001332
software.id: 3
software.name: TopSpin
software.sf category: software
software.sf framecode: software_topspin
software.version: 3

3,bmse001332,1
type: software citation
of datablock: info:bmrb.metabolomics/bmse001332
software citation.citation id: 3
software citation.entry id: bmse001332
software citation.software id: 1
software citation.citation label: citation_alatis

4,bmse001332,2
type: software citation
of datablock: info:bmrb.metabolomics/bmse001332
software citation.citation id: 4
software citation.entry id: bmse001332
software citation.software id: 2
software citation.citation label: citation_nmrbot

H,bmse001332,1,1,Full H
type: spectral dim
of datablock: info:bmrb.metabolomics/bmse001332
spectral dim.atom type: H
spectral dim.entry id: bmse001332
spectral dim.id: 1
spectral dim.spectral peak list id: 1
spectral dim.spectral region: Full H
spectral dim.atom isotope number: 1
spectral dim.sweep width: 16.03
spectral dim.sweep width units: ppm

C,bmse001332,2,2,Full C
type: spectral dim
of datablock: info:bmrb.metabolomics/bmse001332
spectral dim.atom type: C
spectral dim.entry id: bmse001332
spectral dim.id: 2
spectral dim.spectral peak list id: 2
spectral dim.spectral region: Full C
spectral dim.atom isotope number: 13
spectral dim.sweep width: 248.61
spectral dim.sweep width units: ppm

C,bmse001332,3,3,Full C
type: spectral dim
of datablock: info:bmrb.metabolomics/bmse001332
spectral dim.atom type: C
spectral dim.entry id: bmse001332
spectral dim.id: 3
spectral dim.spectral peak list id: 3
spectral dim.spectral region: Full C
spectral dim.atom isotope number: 13
spectral dim.sweep width: 236.77
spectral dim.sweep width units: ppm

C,bmse001332,4,4,Full C
type: spectral dim
of datablock: info:bmrb.metabolomics/bmse001332
spectral dim.atom type: C
spectral dim.entry id: bmse001332
spectral dim.id: 4
spectral dim.spectral peak list id: 4
spectral dim.spectral region: Full C
spectral dim.atom isotope number: 13
spectral dim.sweep width: 236.77
spectral dim.sweep width units: ppm

C,bmse001332,5,5,Full C
type: spectral dim
of datablock: info:bmrb.metabolomics/bmse001332
spectral dim.atom type: C
spectral dim.entry id: bmse001332
spectral dim.id: 5
spectral dim.spectral peak list id: 5
spectral dim.spectral region: Full C
spectral dim.atom isotope number: 13
spectral dim.sweep width: 165.00
spectral dim.sweep width units: ppm

H,bmse001332,6,5,Full H
type: spectral dim
of datablock: info:bmrb.metabolomics/bmse001332
spectral dim.atom type: H
spectral dim.entry id: bmse001332
spectral dim.id: 6
spectral dim.spectral peak list id: 5
spectral dim.spectral region: Full H
spectral dim.atom isotope number: 1
spectral dim.sweep width: 12.99
spectral dim.sweep width units: ppm

H,bmse001332,7,6,Full H
type: spectral dim
of datablock: info:bmrb.metabolomics/bmse001332
spectral dim.atom type: H
spectral dim.entry id: bmse001332
spectral dim.id: 7
spectral dim.spectral peak list id: 6
spectral dim.spectral region: Full H
spectral dim.atom isotope number: 1
spectral dim.sweep width: 16.03
spectral dim.sweep width units: ppm

C,bmse001332,8,7,Full C
type: spectral dim
of datablock: info:bmrb.metabolomics/bmse001332
spectral dim.atom type: C
spectral dim.entry id: bmse001332
spectral dim.id: 8
spectral dim.spectral peak list id: 7
spectral dim.spectral region: Full C
spectral dim.atom isotope number: 13
spectral dim.sweep width: 248.61
spectral dim.sweep width units: ppm

C,bmse001332,9,8,Full C
type: spectral dim
of datablock: info:bmrb.metabolomics/bmse001332
spectral dim.atom type: C
spectral dim.entry id: bmse001332
spectral dim.id: 9
spectral dim.spectral peak list id: 8
spectral dim.spectral region: Full C
spectral dim.atom isotope number: 13
spectral dim.sweep width: 236.77
spectral dim.sweep width units: ppm

C,bmse001332,10,9,Full C
type: spectral dim
of datablock: info:bmrb.metabolomics/bmse001332
spectral dim.atom type: C
spectral dim.entry id: bmse001332
spectral dim.id: 10
spectral dim.spectral peak list id: 9
spectral dim.spectral region: Full C
spectral dim.atom isotope number: 13
spectral dim.sweep width: 236.77
spectral dim.sweep width units: ppm

C,bmse001332,11,10,Full C
type: spectral dim
of datablock: info:bmrb.metabolomics/bmse001332
spectral dim.atom type: C
spectral dim.entry id: bmse001332
spectral dim.id: 11
spectral dim.spectral peak list id: 10
spectral dim.spectral region: Full C
spectral dim.atom isotope number: 13
spectral dim.sweep width: 165.00
spectral dim.sweep width units: ppm

H,bmse001332,12,10,Full H
type: spectral dim
of datablock: info:bmrb.metabolomics/bmse001332
spectral dim.atom type: H
spectral dim.entry id: bmse001332
spectral dim.id: 12
spectral dim.spectral peak list id: 10
spectral dim.spectral region: Full H
spectral dim.atom isotope number: 1
spectral dim.sweep width: 12.99
spectral dim.sweep width units: ppm

bmse001332,1,1
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition.entry id: bmse001332
spectral transition.id: 1
spectral transition.spectral peak list id: 1

bmse001332,2,1
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition.entry id: bmse001332
spectral transition.id: 2
spectral transition.spectral peak list id: 1

bmse001332,3,1
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition.entry id: bmse001332
spectral transition.id: 3
spectral transition.spectral peak list id: 1

bmse001332,4,1
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition.entry id: bmse001332
spectral transition.id: 4
spectral transition.spectral peak list id: 1

bmse001332,5,1
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition.entry id: bmse001332
spectral transition.id: 5
spectral transition.spectral peak list id: 1

bmse001332,6,1
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition.entry id: bmse001332
spectral transition.id: 6
spectral transition.spectral peak list id: 1

bmse001332,7,1
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition.entry id: bmse001332
spectral transition.id: 7
spectral transition.spectral peak list id: 1

bmse001332,8,1
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition.entry id: bmse001332
spectral transition.id: 8
spectral transition.spectral peak list id: 1

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bmse001332,375,8
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bmse001332,376,8
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bmse001332,377,8
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bmse001332,378,8
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bmse001332,379,8
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bmse001332,380,8
type: spectral transition
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bmse001332,381,9
type: spectral transition
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bmse001332,382,9
type: spectral transition
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bmse001332,383,9
type: spectral transition
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bmse001332,384,9
type: spectral transition
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bmse001332,385,9
type: spectral transition
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bmse001332,386,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,387,9
type: spectral transition
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bmse001332,388,9
type: spectral transition
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bmse001332,389,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,390,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,391,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,392,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,393,9
type: spectral transition
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bmse001332,394,9
type: spectral transition
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bmse001332,395,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,396,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,397,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,398,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,399,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,400,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,401,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,402,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,403,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,404,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,405,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,406,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,407,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,408,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,409,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,410,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,411,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,412,9
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,413,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,414,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,415,10
type: spectral transition
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bmse001332,416,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,417,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,418,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,419,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,420,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,421,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,422,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,423,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,424,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,425,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,426,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,427,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,428,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,429,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,430,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,431,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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spectral transition.spectral peak list id: 10

bmse001332,432,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,433,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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bmse001332,434,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
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spectral transition.id: 434
spectral transition.spectral peak list id: 10

bmse001332,435,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition.entry id: bmse001332
spectral transition.id: 435
spectral transition.spectral peak list id: 10

bmse001332,436,10
type: spectral transition
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition.entry id: bmse001332
spectral transition.id: 436
spectral transition.spectral peak list id: 10

bmse001332,1,1,1
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 1
spectral transition char.chem shift val: 5.083265

bmse001332,1,1,2
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 2
spectral transition char.chem shift val: 5.075737

bmse001332,1,1,3
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 3
spectral transition char.chem shift val: 4.702002

bmse001332,1,1,4
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 4
spectral transition char.chem shift val: 4.566215

bmse001332,1,1,5
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 5
spectral transition char.chem shift val: 4.552135

bmse001332,1,1,6
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 6
spectral transition char.chem shift val: 4.549629

bmse001332,1,1,7
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 7
spectral transition char.chem shift val: 4.527813

bmse001332,1,1,8
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 8
spectral transition char.chem shift val: 4.511846

bmse001332,1,1,9
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 9
spectral transition char.chem shift val: 4.343515

bmse001332,1,1,10
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 10
spectral transition char.chem shift val: 4.32787

bmse001332,1,1,11
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 11
spectral transition char.chem shift val: 4.302622

bmse001332,1,1,12
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 12
spectral transition char.chem shift val: 4.286831

bmse001332,1,1,13
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 13
spectral transition char.chem shift val: 4.107537

bmse001332,1,1,14
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 14
spectral transition char.chem shift val: 4.016199

bmse001332,1,1,15
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 15
spectral transition char.chem shift val: 4.009579

bmse001332,1,1,16
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 16
spectral transition char.chem shift val: 3.819824

bmse001332,1,1,17
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 17
spectral transition char.chem shift val: 3.816276

bmse001332,1,1,18
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 18
spectral transition char.chem shift val: 3.81079

bmse001332,1,1,19
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 19
spectral transition char.chem shift val: 3.798845

bmse001332,1,1,20
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 20
spectral transition char.chem shift val: 3.795405

bmse001332,1,1,21
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 21
spectral transition char.chem shift val: 3.787542

bmse001332,1,1,22
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 22
spectral transition char.chem shift val: 3.780754

bmse001332,1,1,23
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 23
spectral transition char.chem shift val: 3.754989

bmse001332,1,1,24
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 24
spectral transition char.chem shift val: 3.750155

bmse001332,1,1,25
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 25
spectral transition char.chem shift val: 3.730147

bmse001332,1,1,26
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 26
spectral transition char.chem shift val: 3.723191

bmse001332,1,1,27
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 27
spectral transition char.chem shift val: 3.713307

bmse001332,1,1,28
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 28
spectral transition char.chem shift val: 3.698673

bmse001332,1,1,29
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 29
spectral transition char.chem shift val: 3.688917

bmse001332,1,1,30
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 30
spectral transition char.chem shift val: 3.680069

bmse001332,1,1,31
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 31
spectral transition char.chem shift val: 3.661305

bmse001332,1,1,32
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 32
spectral transition char.chem shift val: 3.654658

bmse001332,1,1,33
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 33
spectral transition char.chem shift val: 3.648544

bmse001332,1,1,34
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 34
spectral transition char.chem shift val: 3.640036

bmse001332,1,1,35
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 35
spectral transition char.chem shift val: 3.63321

bmse001332,1,1,36
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 36
spectral transition char.chem shift val: 3.625101

bmse001332,1,1,37
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 37
spectral transition char.chem shift val: 3.620578

bmse001332,1,1,38
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 38
spectral transition char.chem shift val: 3.615748

bmse001332,1,1,39
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 39
spectral transition char.chem shift val: 3.607233

bmse001332,1,1,40
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 40
spectral transition char.chem shift val: 3.599688

bmse001332,1,1,41
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 41
spectral transition char.chem shift val: 3.592363

bmse001332,1,1,42
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 42
spectral transition char.chem shift val: 3.587819

bmse001332,1,1,43
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 43
spectral transition char.chem shift val: 3.578215

bmse001332,1,1,44
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 44
spectral transition char.chem shift val: 3.54149

bmse001332,1,1,45
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 45
spectral transition char.chem shift val: 3.534688

bmse001332,1,1,46
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 46
spectral transition char.chem shift val: 3.521474

bmse001332,1,1,47
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 47
spectral transition char.chem shift val: 3.5148

bmse001332,1,1,48
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 48
spectral transition char.chem shift val: 3.507169

bmse001332,1,1,49
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 49
spectral transition char.chem shift val: 3.501468

bmse001332,1,1,50
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 50
spectral transition char.chem shift val: 3.496294

bmse001332,1,1,51
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 51
spectral transition char.chem shift val: 3.488833

bmse001332,1,1,52
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 52
spectral transition char.chem shift val: 3.481069

bmse001332,1,1,53
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 53
spectral transition char.chem shift val: 3.4725

bmse001332,1,1,54
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 54
spectral transition char.chem shift val: 3.468489

bmse001332,1,1,55
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 55
spectral transition char.chem shift val: 3.459402

bmse001332,1,1,56
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 56
spectral transition char.chem shift val: 3.451672

bmse001332,1,1,57
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 57
spectral transition char.chem shift val: 3.446481

bmse001332,1,1,58
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 58
spectral transition char.chem shift val: 3.444097

bmse001332,1,1,59
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 59
spectral transition char.chem shift val: 3.439092

bmse001332,1,1,60
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 60
spectral transition char.chem shift val: 3.436103

bmse001332,1,1,61
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 61
spectral transition char.chem shift val: 3.431983

bmse001332,1,1,62
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 62
spectral transition char.chem shift val: 3.426811

bmse001332,1,1,63
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 63
spectral transition char.chem shift val: 3.424469

bmse001332,1,1,64
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 64
spectral transition char.chem shift val: 3.419156

bmse001332,1,1,65
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 65
spectral transition char.chem shift val: 3.415974

bmse001332,1,1,66
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 66
spectral transition char.chem shift val: 3.411949

bmse001332,1,1,67
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 67
spectral transition char.chem shift val: 3.39628

bmse001332,1,1,68
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 68
spectral transition char.chem shift val: 3.392044

bmse001332,1,1,69
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 69
spectral transition char.chem shift val: 3.376354

bmse001332,1,1,70
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 70
spectral transition char.chem shift val: 3.166725

bmse001332,1,1,71
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 71
spectral transition char.chem shift val: 3.154716

bmse001332,1,1,72
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 72
spectral transition char.chem shift val: 3.149806

bmse001332,1,1,73
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 73
spectral transition char.chem shift val: 3.137064

bmse001332,1,1,74
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 74
spectral transition char.chem shift val: 3.125545

bmse001332,1,1,75
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 75
spectral transition char.chem shift val: 3.120276

bmse001332,1,1,76
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 76
spectral transition char.chem shift val: 2.786719

bmse001332,1,1,77
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 77
spectral transition char.chem shift val: 2.771002

bmse001332,1,1,78
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 78
spectral transition char.chem shift val: 2.755053

bmse001332,1,1,79
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 79
spectral transition char.chem shift val: 2.024543

bmse001332,1,1,80
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 80
spectral transition char.chem shift val: 1.991715

bmse001332,1,1,81
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 81
spectral transition char.chem shift val: 1.983248

bmse001332,1,1,82
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 82
spectral transition char.chem shift val: 1.897295

bmse001332,1,1,83
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 83
spectral transition char.chem shift val: 1.889293

bmse001332,1,1,84
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 84
spectral transition char.chem shift val: 1.758635

bmse001332,1,1,85
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 85
spectral transition char.chem shift val: 1.651199

bmse001332,1,1,86
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 86
spectral transition char.chem shift val: 1.63467

bmse001332,1,1,87
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 87
spectral transition char.chem shift val: 1.617501

bmse001332,1,1,88
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 88
spectral transition char.chem shift val: 1.601511

bmse001332,1,1,89
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 89
spectral transition char.chem shift val: 1.098326

bmse001332,1,1,90
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 90
spectral transition char.chem shift val: 0.955311

bmse001332,1,1,91
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 91
spectral transition char.chem shift val: 0.504906

bmse001332,1,1,92
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 92
spectral transition char.chem shift val: 0.48766

bmse001332,1,1,93
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 1
spectral transition char.spectral transition id: 93
spectral transition char.chem shift val: 0.470877

bmse001332,1,2,1
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 1
spectral transition char.chem shift val: 177.6813

bmse001332,1,2,2
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 2
spectral transition char.chem shift val: 105.6494

bmse001332,1,2,3
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 3
spectral transition char.chem shift val: 105.6261

bmse001332,1,2,4
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 4
spectral transition char.chem shift val: 105.5822

bmse001332,1,2,5
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 5
spectral transition char.chem shift val: 105.5254

bmse001332,1,2,6
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 6
spectral transition char.chem shift val: 98.47122

bmse001332,1,2,7
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 7
spectral transition char.chem shift val: 94.53493

bmse001332,1,2,8
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 8
spectral transition char.chem shift val: 84.78882

bmse001332,1,2,9
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 9
spectral transition char.chem shift val: 81.03968

bmse001332,1,2,10
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 10
spectral transition char.chem shift val: 80.92612

bmse001332,1,2,11
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 11
spectral transition char.chem shift val: 80.80696

bmse001332,1,2,12
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 12
spectral transition char.chem shift val: 78.08481

bmse001332,1,2,13
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 13
spectral transition char.chem shift val: 77.61734

bmse001332,1,2,14
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 14
spectral transition char.chem shift val: 77.53472

bmse001332,1,2,15
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 15
spectral transition char.chem shift val: 77.27920

bmse001332,1,2,16
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 16
spectral transition char.chem shift val: 77.06735

bmse001332,1,2,17
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 17
spectral transition char.chem shift val: 76.50218

bmse001332,1,2,18
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 18
spectral transition char.chem shift val: 75.21222

bmse001332,1,2,19
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 19
spectral transition char.chem shift val: 74.89162

bmse001332,1,2,20
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 20
spectral transition char.chem shift val: 74.12185

bmse001332,1,2,21
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 21
spectral transition char.chem shift val: 73.84052

bmse001332,1,2,22
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 22
spectral transition char.chem shift val: 73.69023

bmse001332,1,2,23
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 23
spectral transition char.chem shift val: 72.85082

bmse001332,1,2,24
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 24
spectral transition char.chem shift val: 72.72360

bmse001332,1,2,25
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 25
spectral transition char.chem shift val: 72.70222

bmse001332,1,2,26
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 26
spectral transition char.chem shift val: 71.26178

bmse001332,1,2,27
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 27
spectral transition char.chem shift val: 71.06657

bmse001332,1,2,28
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 28
spectral transition char.chem shift val: 63.75964

bmse001332,1,2,29
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 29
spectral transition char.chem shift val: 63.69801

bmse001332,1,2,30
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 30
spectral transition char.chem shift val: 62.76052

bmse001332,1,2,31
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 31
spectral transition char.chem shift val: 62.62630

bmse001332,1,2,32
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 32
spectral transition char.chem shift val: 62.54477

bmse001332,1,2,33
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 33
spectral transition char.chem shift val: 57.90703

bmse001332,1,2,34
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 2
spectral transition char.spectral transition id: 34
spectral transition char.chem shift val: 24.91350

bmse001332,1,3,1
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 1
spectral transition char.chem shift val: 105.6476

bmse001332,1,3,2
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 2
spectral transition char.chem shift val: 105.6226

bmse001332,1,3,3
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 3
spectral transition char.chem shift val: 105.5792

bmse001332,1,3,4
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 4
spectral transition char.chem shift val: 105.5256

bmse001332,1,3,5
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 5
spectral transition char.chem shift val: 98.46838

bmse001332,1,3,6
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 6
spectral transition char.chem shift val: 94.53422

bmse001332,1,3,7
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 7
spectral transition char.chem shift val: 84.78652

bmse001332,1,3,8
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 8
spectral transition char.chem shift val: 81.03345

bmse001332,1,3,9
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 9
spectral transition char.chem shift val: 80.91997

bmse001332,1,3,10
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 10
spectral transition char.chem shift val: 80.79984

bmse001332,1,3,11
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 11
spectral transition char.chem shift val: 78.08325

bmse001332,1,3,12
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 12
spectral transition char.chem shift val: 77.61526

bmse001332,1,3,13
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 13
spectral transition char.chem shift val: 77.53233

bmse001332,1,3,14
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 14
spectral transition char.chem shift val: 77.27791

bmse001332,1,3,15
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 15
spectral transition char.chem shift val: 77.06625

bmse001332,1,3,16
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 16
spectral transition char.chem shift val: 76.49886

bmse001332,1,3,17
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 17
spectral transition char.chem shift val: 75.20919

bmse001332,1,3,18
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 18
spectral transition char.chem shift val: 74.88914

bmse001332,1,3,19
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 19
spectral transition char.chem shift val: 74.12050

bmse001332,1,3,20
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 20
spectral transition char.chem shift val: 73.83851

bmse001332,1,3,21
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 21
spectral transition char.chem shift val: 73.68837

bmse001332,1,3,22
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 22
spectral transition char.chem shift val: 72.84915

bmse001332,1,3,23
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 23
spectral transition char.chem shift val: 72.72002

bmse001332,1,3,24
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 24
spectral transition char.chem shift val: 72.69913

bmse001332,1,3,25
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 25
spectral transition char.chem shift val: 71.25984

bmse001332,1,3,26
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 26
spectral transition char.chem shift val: 71.08499

bmse001332,1,3,27
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 27
spectral transition char.chem shift val: 71.06538

bmse001332,1,3,28
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 3
spectral transition char.spectral transition id: 28
spectral transition char.chem shift val: 57.90525

bmse001332,1,4,1
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 1
spectral transition char.chem shift val: 105.6462

bmse001332,1,4,2
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 2
spectral transition char.chem shift val: 105.6195

bmse001332,1,4,3
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 3
spectral transition char.chem shift val: 105.5762

bmse001332,1,4,4
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 4
spectral transition char.chem shift val: 105.5231

bmse001332,1,4,5
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 5
spectral transition char.chem shift val: 98.46543

bmse001332,1,4,6
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 6
spectral transition char.chem shift val: 94.53237

bmse001332,1,4,7
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 7
spectral transition char.chem shift val: 84.78523

bmse001332,1,4,8
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 8
spectral transition char.chem shift val: 84.77174

bmse001332,1,4,9
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 9
spectral transition char.chem shift val: 81.03088

bmse001332,1,4,10
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 10
spectral transition char.chem shift val: 80.91836

bmse001332,1,4,11
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 11
spectral transition char.chem shift val: 80.79749

bmse001332,1,4,12
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 12
spectral transition char.chem shift val: 78.08062

bmse001332,1,4,13
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 13
spectral transition char.chem shift val: 77.61288

bmse001332,1,4,14
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 14
spectral transition char.chem shift val: 77.53001

bmse001332,1,4,15
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 15
spectral transition char.chem shift val: 77.27618

bmse001332,1,4,16
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 16
spectral transition char.chem shift val: 77.06466

bmse001332,1,4,17
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 17
spectral transition char.chem shift val: 76.49647

bmse001332,1,4,18
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 18
spectral transition char.chem shift val: 75.20776

bmse001332,1,4,19
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 19
spectral transition char.chem shift val: 74.88673

bmse001332,1,4,20
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 20
spectral transition char.chem shift val: 74.11885

bmse001332,1,4,21
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 21
spectral transition char.chem shift val: 73.8368

bmse001332,1,4,22
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 22
spectral transition char.chem shift val: 73.68592

bmse001332,1,4,23
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 23
spectral transition char.chem shift val: 72.84702

bmse001332,1,4,24
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 24
spectral transition char.chem shift val: 72.72184

bmse001332,1,4,25
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 25
spectral transition char.chem shift val: 72.69620

bmse001332,1,4,26
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 26
spectral transition char.chem shift val: 71.25758

bmse001332,1,4,27
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 27
spectral transition char.chem shift val: 71.08593

bmse001332,1,4,28
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 28
spectral transition char.chem shift val: 71.06271

bmse001332,1,4,29
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 29
spectral transition char.chem shift val: 63.75702

bmse001332,1,4,30
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 30
spectral transition char.chem shift val: 63.69252

bmse001332,1,4,31
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 31
spectral transition char.chem shift val: 62.75488

bmse001332,1,4,32
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 32
spectral transition char.chem shift val: 62.62112

bmse001332,1,4,33
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 33
spectral transition char.chem shift val: 62.54037

bmse001332,1,4,34
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 34
spectral transition char.chem shift val: 57.90315

bmse001332,1,4,35
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 4
spectral transition char.spectral transition id: 35
spectral transition char.chem shift val: 24.91030

bmse001332,1,5,1
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 1
spectral transition char.chem shift val: 105.5338

bmse001332,2,5,1
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 1
spectral transition char.chem shift val: 4.443442

bmse001332,1,5,2
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 2
spectral transition char.chem shift val: 105.5743

bmse001332,2,5,2
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 2
spectral transition char.chem shift val: 4.479454

bmse001332,1,5,3
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 3
spectral transition char.chem shift val: 105.4529

bmse001332,2,5,3
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 3
spectral transition char.chem shift val: 4.703527

bmse001332,1,5,4
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 4
spectral transition char.chem shift val: 98.49553

bmse001332,2,5,4
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 4
spectral transition char.chem shift val: 4.657512

bmse001332,1,5,5
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 5
spectral transition char.chem shift val: 94.61233

bmse001332,2,5,5
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 5
spectral transition char.chem shift val: 5.217693

bmse001332,1,5,6
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 6
spectral transition char.chem shift val: 84.66099

bmse001332,2,5,6
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 6
spectral transition char.chem shift val: 3.722753

bmse001332,1,5,7
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 7
spectral transition char.chem shift val: 80.85811

bmse001332,2,5,7
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 7
spectral transition char.chem shift val: 3.633088

bmse001332,1,5,8
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 8
spectral transition char.chem shift val: 80.73342

bmse001332,2,5,8
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 8
spectral transition char.chem shift val: 3.732716

bmse001332,1,5,9
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 9
spectral transition char.chem shift val: 77.80333

bmse001332,2,5,9
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 9
spectral transition char.chem shift val: 3.742679

bmse001332,1,5,10
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 10
spectral transition char.chem shift val: 77.30459

bmse001332,2,5,10
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 10
spectral transition char.chem shift val: 3.583275

bmse001332,1,5,11
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 11
spectral transition char.chem shift val: 77.24225

bmse001332,2,5,11
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 11
spectral transition char.chem shift val: 3.636409

bmse001332,1,5,12
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 12
spectral transition char.chem shift val: 76.36945

bmse001332,2,5,12
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 12
spectral transition char.chem shift val: 3.284392

bmse001332,1,5,13
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 13
spectral transition char.chem shift val: 75.06026

bmse001332,2,5,13
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 13
spectral transition char.chem shift val: 3.662977

bmse001332,1,5,14
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 14
spectral transition char.chem shift val: 74.87324

bmse001332,2,5,14
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 14
spectral transition char.chem shift val: 3.729395

bmse001332,1,5,15
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 15
spectral transition char.chem shift val: 74.06278

bmse001332,2,5,15
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 15
spectral transition char.chem shift val: 3.819060

bmse001332,1,5,16
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 16
spectral transition char.chem shift val: 73.62639

bmse001332,2,5,16
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 16
spectral transition char.chem shift val: 3.540103

bmse001332,1,5,17
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 17
spectral transition char.chem shift val: 72.69125

bmse001332,2,5,17
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 17
spectral transition char.chem shift val: 3.586595

bmse001332,1,5,18
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 18
spectral transition char.chem shift val: 72.62891

bmse001332,2,5,18
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 18
spectral transition char.chem shift val: 3.941934

bmse001332,1,5,19
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 19
spectral transition char.chem shift val: 71.25738

bmse001332,2,5,19
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 19
spectral transition char.chem shift val: 3.925329

bmse001332,1,5,20
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 20
spectral transition char.chem shift val: 71.00801

bmse001332,2,5,20
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 20
spectral transition char.chem shift val: 4.161115

bmse001332,1,5,21
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 21
spectral transition char.chem shift val: 63.77629

bmse001332,2,5,21
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 21
spectral transition char.chem shift val: 3.749321

bmse001332,1,5,22
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 22
spectral transition char.chem shift val: 62.77881

bmse001332,2,5,22
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 22
spectral transition char.chem shift val: 3.789172

bmse001332,1,5,23
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 23
spectral transition char.chem shift val: 62.52944

bmse001332,2,5,23
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 23
spectral transition char.chem shift val: 3.852269

bmse001332,1,5,24
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 24
spectral transition char.chem shift val: 62.52944

bmse001332,2,5,24
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 24
spectral transition char.chem shift val: 3.948576

bmse001332,1,5,25
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 25
spectral transition char.chem shift val: 57.85376

bmse001332,2,5,25
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 25
spectral transition char.chem shift val: 3.799134

bmse001332,1,5,26
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 26
spectral transition char.chem shift val: 24.84043

bmse001332,2,5,26
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 5
spectral transition char.spectral transition id: 26
spectral transition char.chem shift val: 2.030042

bmse001332,1,6,1
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 1
spectral transition char.chem shift val: 7.724623

bmse001332,1,6,2
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 2
spectral transition char.chem shift val: 7.714271

bmse001332,1,6,3
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 3
spectral transition char.chem shift val: 7.708301

bmse001332,1,6,4
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 4
spectral transition char.chem shift val: 7.697184

bmse001332,1,6,5
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 5
spectral transition char.chem shift val: 6.700497

bmse001332,1,6,6
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 6
spectral transition char.chem shift val: 6.687502

bmse001332,1,6,7
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 7
spectral transition char.chem shift val: 6.359628

bmse001332,1,6,8
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 8
spectral transition char.chem shift val: 6.350646

bmse001332,1,6,9
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 9
spectral transition char.chem shift val: 5.112075

bmse001332,1,6,10
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 10
spectral transition char.chem shift val: 5.108271

bmse001332,1,6,11
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 11
spectral transition char.chem shift val: 5.103326

bmse001332,1,6,12
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 12
spectral transition char.chem shift val: 5.012833

bmse001332,1,6,13
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 13
spectral transition char.chem shift val: 5.002985

bmse001332,1,6,14
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 14
spectral transition char.chem shift val: 4.902039

bmse001332,1,6,15
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 15
spectral transition char.chem shift val: 4.893688

bmse001332,1,6,16
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 16
spectral transition char.chem shift val: 4.885685

bmse001332,1,6,17
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 17
spectral transition char.chem shift val: 4.847765

bmse001332,1,6,18
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 18
spectral transition char.chem shift val: 4.840246

bmse001332,1,6,19
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 19
spectral transition char.chem shift val: 4.828308

bmse001332,1,6,20
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 20
spectral transition char.chem shift val: 4.822325

bmse001332,1,6,21
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 21
spectral transition char.chem shift val: 4.817685

bmse001332,1,6,22
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 22
spectral transition char.chem shift val: 4.577061

bmse001332,1,6,23
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 23
spectral transition char.chem shift val: 4.573964

bmse001332,1,6,24
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 24
spectral transition char.chem shift val: 4.564902

bmse001332,1,6,25
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 25
spectral transition char.chem shift val: 4.552477

bmse001332,1,6,26
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 26
spectral transition char.chem shift val: 4.541871

bmse001332,1,6,27
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 27
spectral transition char.chem shift val: 4.532712

bmse001332,1,6,28
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 28
spectral transition char.chem shift val: 4.511537

bmse001332,1,6,29
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 29
spectral transition char.chem shift val: 4.499617

bmse001332,1,6,30
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 30
spectral transition char.chem shift val: 4.487333

bmse001332,1,6,31
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 31
spectral transition char.chem shift val: 4.415211

bmse001332,1,6,32
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 32
spectral transition char.chem shift val: 4.412545

bmse001332,1,6,33
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 33
spectral transition char.chem shift val: 4.327567

bmse001332,1,6,34
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 34
spectral transition char.chem shift val: 4.289588

bmse001332,1,6,35
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 35
spectral transition char.chem shift val: 4.279952

bmse001332,1,6,36
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 36
spectral transition char.chem shift val: 4.253412

bmse001332,1,6,37
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 37
spectral transition char.chem shift val: 4.239066

bmse001332,1,6,38
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 38
spectral transition char.chem shift val: 4.22725

bmse001332,1,6,39
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 39
spectral transition char.chem shift val: 4.212896

bmse001332,1,6,40
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 40
spectral transition char.chem shift val: 4.198568

bmse001332,1,6,41
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 41
spectral transition char.chem shift val: 4.191148

bmse001332,1,6,42
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 42
spectral transition char.chem shift val: 4.183767

bmse001332,1,6,43
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 43
spectral transition char.chem shift val: 3.841928

bmse001332,1,6,44
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 44
spectral transition char.chem shift val: 3.836839

bmse001332,1,6,45
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 45
spectral transition char.chem shift val: 3.832955

bmse001332,1,6,46
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 46
spectral transition char.chem shift val: 3.764473

bmse001332,1,6,47
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 47
spectral transition char.chem shift val: 3.752808

bmse001332,1,6,48
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 48
spectral transition char.chem shift val: 3.743486

bmse001332,1,6,49
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 49
spectral transition char.chem shift val: 3.730256

bmse001332,1,6,50
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 50
spectral transition char.chem shift val: 3.722429

bmse001332,1,6,51
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 51
spectral transition char.chem shift val: 3.71579

bmse001332,1,6,52
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 52
spectral transition char.chem shift val: 3.709033

bmse001332,1,6,53
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 53
spectral transition char.chem shift val: 3.702745

bmse001332,1,6,54
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 54
spectral transition char.chem shift val: 3.696153

bmse001332,1,6,55
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 55
spectral transition char.chem shift val: 3.689368

bmse001332,1,6,56
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 56
spectral transition char.chem shift val: 3.649341

bmse001332,1,6,57
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 57
spectral transition char.chem shift val: 3.637145

bmse001332,1,6,58
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 58
spectral transition char.chem shift val: 3.630631

bmse001332,1,6,59
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 59
spectral transition char.chem shift val: 3.610905

bmse001332,1,6,60
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 60
spectral transition char.chem shift val: 3.600705

bmse001332,1,6,61
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 61
spectral transition char.chem shift val: 3.59471

bmse001332,1,6,62
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 62
spectral transition char.chem shift val: 3.574154

bmse001332,1,6,63
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 63
spectral transition char.chem shift val: 3.571808

bmse001332,1,6,64
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 64
spectral transition char.chem shift val: 3.554188

bmse001332,1,6,65
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 65
spectral transition char.chem shift val: 3.535505

bmse001332,1,6,66
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 66
spectral transition char.chem shift val: 3.527371

bmse001332,1,6,67
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 67
spectral transition char.chem shift val: 3.518623

bmse001332,1,6,68
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 68
spectral transition char.chem shift val: 3.509308

bmse001332,1,6,69
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 69
spectral transition char.chem shift val: 3.500113

bmse001332,1,6,70
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 70
spectral transition char.chem shift val: 3.489931

bmse001332,1,6,71
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 71
spectral transition char.chem shift val: 3.479191

bmse001332,1,6,72
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 72
spectral transition char.chem shift val: 3.473894

bmse001332,1,6,73
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 73
spectral transition char.chem shift val: 3.467538

bmse001332,1,6,74
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 74
spectral transition char.chem shift val: 3.460017

bmse001332,1,6,75
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 75
spectral transition char.chem shift val: 3.450971

bmse001332,1,6,76
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 76
spectral transition char.chem shift val: 3.437933

bmse001332,1,6,77
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 77
spectral transition char.chem shift val: 3.426153

bmse001332,1,6,78
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 78
spectral transition char.chem shift val: 3.420454

bmse001332,1,6,79
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 79
spectral transition char.chem shift val: 3.407651

bmse001332,1,6,80
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 80
spectral transition char.chem shift val: 3.403451

bmse001332,1,6,81
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 81
spectral transition char.chem shift val: 3.399897

bmse001332,1,6,82
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 82
spectral transition char.chem shift val: 3.398027

bmse001332,1,6,83
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 83
spectral transition char.chem shift val: 3.395008

bmse001332,1,6,84
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 84
spectral transition char.chem shift val: 3.394153

bmse001332,1,6,85
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 85
spectral transition char.chem shift val: 3.393092

bmse001332,1,6,86
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 86
spectral transition char.chem shift val: 3.334414

bmse001332,1,6,87
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 87
spectral transition char.chem shift val: 3.327452

bmse001332,1,6,88
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 88
spectral transition char.chem shift val: 3.324547

bmse001332,1,6,89
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 89
spectral transition char.chem shift val: 3.304993

bmse001332,1,6,90
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 90
spectral transition char.chem shift val: 3.294684

bmse001332,1,6,91
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 91
spectral transition char.chem shift val: 3.277085

bmse001332,1,6,92
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 92
spectral transition char.chem shift val: 3.258455

bmse001332,1,6,93
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 93
spectral transition char.chem shift val: 3.184005

bmse001332,1,6,94
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 94
spectral transition char.chem shift val: 3.177287

bmse001332,1,6,95
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 95
spectral transition char.chem shift val: 3.170015

bmse001332,1,6,96
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 96
spectral transition char.chem shift val: 3.164359

bmse001332,1,6,97
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 97
spectral transition char.chem shift val: 3.15905

bmse001332,1,6,98
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 98
spectral transition char.chem shift val: 3.151891

bmse001332,1,6,99
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 99
spectral transition char.chem shift val: 3.144819

bmse001332,1,6,100
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 100
spectral transition char.chem shift val: 2.512054

bmse001332,1,6,101
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 101
spectral transition char.chem shift val: 2.508529

bmse001332,1,6,102
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 102
spectral transition char.chem shift val: 2.504916

bmse001332,1,6,103
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 103
spectral transition char.chem shift val: 2.501312

bmse001332,1,6,104
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 104
spectral transition char.chem shift val: 2.497814

bmse001332,1,6,105
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 105
spectral transition char.chem shift val: 1.92054

bmse001332,1,6,106
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 6
spectral transition char.spectral transition id: 106
spectral transition char.chem shift val: 1.809359

bmse001332,1,7,1
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 1
spectral transition char.chem shift val: 169.5977

bmse001332,1,7,2
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 2
spectral transition char.chem shift val: 104.0979

bmse001332,1,7,3
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 3
spectral transition char.chem shift val: 103.6014

bmse001332,1,7,4
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 4
spectral transition char.chem shift val: 103.5521

bmse001332,1,7,5
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 5
spectral transition char.chem shift val: 102.1396

bmse001332,1,7,6
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 6
spectral transition char.chem shift val: 96.64998

bmse001332,1,7,7
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 7
spectral transition char.chem shift val: 92.06090

bmse001332,1,7,8
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 8
spectral transition char.chem shift val: 82.01693

bmse001332,1,7,9
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 9
spectral transition char.chem shift val: 81.95945

bmse001332,1,7,10
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 10
spectral transition char.chem shift val: 81.43663

bmse001332,1,7,11
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 11
spectral transition char.chem shift val: 81.29351

bmse001332,1,7,12
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 12
spectral transition char.chem shift val: 80.94844

bmse001332,1,7,13
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 13
spectral transition char.chem shift val: 75.60755

bmse001332,1,7,14
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 14
spectral transition char.chem shift val: 75.24386

bmse001332,1,7,15
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 15
spectral transition char.chem shift val: 74.99085

bmse001332,1,7,16
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 16
spectral transition char.chem shift val: 74.87009

bmse001332,1,7,17
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 17
spectral transition char.chem shift val: 74.71178

bmse001332,1,7,18
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 18
spectral transition char.chem shift val: 74.50478

bmse001332,1,7,19
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 19
spectral transition char.chem shift val: 73.22661

bmse001332,1,7,20
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 20
spectral transition char.chem shift val: 72.13611

bmse001332,1,7,21
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 21
spectral transition char.chem shift val: 71.35498

bmse001332,1,7,22
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 22
spectral transition char.chem shift val: 70.60233

bmse001332,1,7,23
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 23
spectral transition char.chem shift val: 69.79945

bmse001332,1,7,24
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 24
spectral transition char.chem shift val: 69.58295

bmse001332,1,7,25
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 25
spectral transition char.chem shift val: 68.22427

bmse001332,1,7,26
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 26
spectral transition char.chem shift val: 67.33466

bmse001332,1,7,27
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 27
spectral transition char.chem shift val: 60.54464

bmse001332,1,7,28
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 28
spectral transition char.chem shift val: 60.47657

bmse001332,1,7,29
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 29
spectral transition char.chem shift val: 60.36441

bmse001332,1,7,30
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 30
spectral transition char.chem shift val: 55.51371

bmse001332,1,7,31
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 7
spectral transition char.spectral transition id: 31
spectral transition char.chem shift val: 23.23645

bmse001332,1,8,1
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 1
spectral transition char.chem shift val: 103.8418

bmse001332,1,8,2
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 2
spectral transition char.chem shift val: 103.3464

bmse001332,1,8,3
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 3
spectral transition char.chem shift val: 103.2961

bmse001332,1,8,4
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 4
spectral transition char.chem shift val: 101.8840

bmse001332,1,8,5
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 5
spectral transition char.chem shift val: 96.39498

bmse001332,1,8,6
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 6
spectral transition char.chem shift val: 91.80544

bmse001332,1,8,7
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 7
spectral transition char.chem shift val: 81.76029

bmse001332,1,8,8
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 8
spectral transition char.chem shift val: 81.70375

bmse001332,1,8,9
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 9
spectral transition char.chem shift val: 81.18093

bmse001332,1,8,10
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 10
spectral transition char.chem shift val: 81.03753

bmse001332,1,8,11
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 11
spectral transition char.chem shift val: 80.69242

bmse001332,1,8,12
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 12
spectral transition char.chem shift val: 75.35157

bmse001332,1,8,13
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 13
spectral transition char.chem shift val: 74.98718

bmse001332,1,8,14
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 14
spectral transition char.chem shift val: 74.73387

bmse001332,1,8,15
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 15
spectral transition char.chem shift val: 74.61298

bmse001332,1,8,16
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 16
spectral transition char.chem shift val: 74.45562

bmse001332,1,8,17
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 17
spectral transition char.chem shift val: 74.24775

bmse001332,1,8,18
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 18
spectral transition char.chem shift val: 72.97004

bmse001332,1,8,19
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 19
spectral transition char.chem shift val: 71.87972

bmse001332,1,8,20
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 20
spectral transition char.chem shift val: 71.09796

bmse001332,1,8,21
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 21
spectral transition char.chem shift val: 70.34596

bmse001332,1,8,22
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 22
spectral transition char.chem shift val: 69.54301

bmse001332,1,8,23
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 23
spectral transition char.chem shift val: 69.32644

bmse001332,1,8,24
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 24
spectral transition char.chem shift val: 69.28818

bmse001332,1,8,25
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 25
spectral transition char.chem shift val: 67.96766

bmse001332,1,8,26
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 26
spectral transition char.chem shift val: 67.07796

bmse001332,1,8,27
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 8
spectral transition char.spectral transition id: 27
spectral transition char.chem shift val: 55.25640

bmse001332,1,9,1
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 1
spectral transition char.chem shift val: 103.8402

bmse001332,1,9,2
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 2
spectral transition char.chem shift val: 103.3440

bmse001332,1,9,3
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 3
spectral transition char.chem shift val: 103.2928

bmse001332,1,9,4
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 4
spectral transition char.chem shift val: 101.8823

bmse001332,1,9,5
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 5
spectral transition char.chem shift val: 96.39336

bmse001332,1,9,6
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 6
spectral transition char.chem shift val: 91.80360

bmse001332,1,9,7
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 7
spectral transition char.chem shift val: 81.76045

bmse001332,1,9,8
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 8
spectral transition char.chem shift val: 81.70284

bmse001332,1,9,9
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 9
spectral transition char.chem shift val: 81.17999

bmse001332,1,9,10
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 10
spectral transition char.chem shift val: 81.03564

bmse001332,1,9,11
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 11
spectral transition char.chem shift val: 80.69202

bmse001332,1,9,12
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 12
spectral transition char.chem shift val: 75.35094

bmse001332,1,9,13
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 13
spectral transition char.chem shift val: 74.98564

bmse001332,1,9,14
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 14
spectral transition char.chem shift val: 74.73270

bmse001332,1,9,15
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 15
spectral transition char.chem shift val: 74.61145

bmse001332,1,9,16
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 16
spectral transition char.chem shift val: 74.45478

bmse001332,1,9,17
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 17
spectral transition char.chem shift val: 74.24695

bmse001332,1,9,18
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 18
spectral transition char.chem shift val: 72.9692

bmse001332,1,9,19
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 19
spectral transition char.chem shift val: 71.87830

bmse001332,1,9,20
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 20
spectral transition char.chem shift val: 71.09703

bmse001332,1,9,21
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 21
spectral transition char.chem shift val: 70.34529

bmse001332,1,9,22
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 22
spectral transition char.chem shift val: 69.54256

bmse001332,1,9,23
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 23
spectral transition char.chem shift val: 69.32594

bmse001332,1,9,24
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 24
spectral transition char.chem shift val: 69.28461

bmse001332,1,9,25
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 25
spectral transition char.chem shift val: 67.96711

bmse001332,1,9,26
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 26
spectral transition char.chem shift val: 67.07803

bmse001332,1,9,27
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 27
spectral transition char.chem shift val: 60.28717

bmse001332,1,9,28
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 28
spectral transition char.chem shift val: 60.25855

bmse001332,1,9,29
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 29
spectral transition char.chem shift val: 60.21646

bmse001332,1,9,30
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 30
spectral transition char.chem shift val: 60.10634

bmse001332,1,9,31
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 31
spectral transition char.chem shift val: 55.25578

bmse001332,1,9,32
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 9
spectral transition char.spectral transition id: 32
spectral transition char.chem shift val: 22.98137

bmse001332,1,10,1
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 1
spectral transition char.chem shift val: 103.7522

bmse001332,2,10,1
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 1
spectral transition char.chem shift val: 4.191443

bmse001332,1,10,2
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 2
spectral transition char.chem shift val: 103.3574

bmse001332,2,10,2
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 2
spectral transition char.chem shift val: 4.219763

bmse001332,1,10,3
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 3
spectral transition char.chem shift val: 101.8572

bmse001332,2,10,3
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 3
spectral transition char.chem shift val: 4.646594

bmse001332,1,10,4
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 4
spectral transition char.chem shift val: 96.40905

bmse001332,2,10,4
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 4
spectral transition char.chem shift val: 4.326977

bmse001332,1,10,5
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 5
spectral transition char.chem shift val: 91.83709

bmse001332,2,10,5
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 5
spectral transition char.chem shift val: 4.890142

bmse001332,1,10,6
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 6
spectral transition char.chem shift val: 81.65544

bmse001332,2,10,6
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 6
spectral transition char.chem shift val: 3.431340

bmse001332,1,10,7
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 7
spectral transition char.chem shift val: 81.00603

bmse001332,2,10,7
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 7
spectral transition char.chem shift val: 3.280534

bmse001332,1,10,8
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 8
spectral transition char.chem shift val: 75.16129

bmse001332,2,10,8
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 8
spectral transition char.chem shift val: 3.464635

bmse001332,1,10,9
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 9
spectral transition char.chem shift val: 74.58023

bmse001332,2,10,9
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 9
spectral transition char.chem shift val: 3.276617

bmse001332,1,10,10
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 10
spectral transition char.chem shift val: 73.11050

bmse001332,2,10,10
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 10
spectral transition char.chem shift val: 3.300119

bmse001332,1,10,11
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 11
spectral transition char.chem shift val: 71.88003

bmse001332,2,10,11
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 11
spectral transition char.chem shift val: 3.166939

bmse001332,1,10,12
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 12
spectral transition char.chem shift val: 71.77749

bmse001332,2,10,12
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 12
spectral transition char.chem shift val: 3.529267

bmse001332,1,10,13
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 13
spectral transition char.chem shift val: 71.19644

bmse001332,2,10,13
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 13
spectral transition char.chem shift val: 3.550811

bmse001332,1,10,14
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 14
spectral transition char.chem shift val: 70.37612

bmse001332,2,10,14
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 14
spectral transition char.chem shift val: 3.300119

bmse001332,1,10,15
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 15
spectral transition char.chem shift val: 69.52163

bmse001332,2,10,15
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 15
spectral transition char.chem shift val: 3.701617

bmse001332,1,10,16
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 16
spectral transition char.chem shift val: 69.28237

bmse001332,2,10,16
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 16
spectral transition char.chem shift val: 3.425465

bmse001332,1,10,17
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 17
spectral transition char.chem shift val: 68.05190

bmse001332,2,10,17
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 17
spectral transition char.chem shift val: 3.595857

bmse001332,1,10,18
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 18
spectral transition char.chem shift val: 67.19741

bmse001332,2,10,18
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 18
spectral transition char.chem shift val: 3.832839

bmse001332,1,10,19
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 19
spectral transition char.chem shift val: 60.26630

bmse001332,2,10,19
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 19
spectral transition char.chem shift val: 3.492103

bmse001332,1,10,20
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 20
spectral transition char.chem shift val: 60.20899

bmse001332,2,10,20
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 20
spectral transition char.chem shift val: 3.630760

bmse001332,1,10,21
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 21
spectral transition char.chem shift val: 60.26630

bmse001332,2,10,21
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 21
spectral transition char.chem shift val: 3.743740

bmse001332,1,10,22
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 22
spectral transition char.chem shift val: 60.00838

bmse001332,2,10,22
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 22
spectral transition char.chem shift val: 3.489535

bmse001332,1,10,23
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 23
spectral transition char.chem shift val: 55.25127

bmse001332,2,10,23
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 23
spectral transition char.chem shift val: 3.425342

bmse001332,1,10,24
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 1
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 24
spectral transition char.chem shift val: 23.00226

bmse001332,2,10,24
type: spectral transition char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition char.entry id: bmse001332
spectral transition char.spectral dim id: 2
spectral transition char.spectral peak list id: 10
spectral transition char.spectral transition id: 24
spectral transition char.chem shift val: 1.801206

bmse001332,961.8343,1,1
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 961.8343
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 1

bmse001332,956.7565,1,2
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 956.7565
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 2

bmse001332,35.97868,1,3
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 35.97868
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 3

bmse001332,914.7054,1,4
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 914.7054
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 4

bmse001332,789.2872,1,5
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 789.2872
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 5

bmse001332,974.0056,1,6
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 974.0056
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 6

bmse001332,1425.006,1,7
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1425.006
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 7

bmse001332,1462.507,1,8
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1462.507
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 8

bmse001332,2368.969,1,9
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2368.969
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 9

bmse001332,2506.517,1,10
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2506.517
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 10

bmse001332,1916.428,1,11
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1916.428
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 11

bmse001332,2012.329,1,12
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2012.329
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 12

bmse001332,-19.34179,1,13
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: -19.34179
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 13

bmse001332,2219.405,1,14
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2219.405
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 14

bmse001332,2349.456,1,15
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2349.456
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 15

bmse001332,1832.263,1,16
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1832.263
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 16

bmse001332,1340.001,1,17
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1340.001
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 17

bmse001332,668.1759,1,18
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 668.1759
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 18

bmse001332,2099.308,1,19
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2099.308
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 19

bmse001332,2817.507,1,20
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2817.507
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 20

bmse001332,3267.04,1,21
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 3267.04
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 21

bmse001332,3048.655,1,22
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 3048.655
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 22

bmse001332,460.7065,1,23
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 460.7065
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 23

bmse001332,470.8026,1,24
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 470.8026
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 24

bmse001332,993.5342,1,25
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 993.5342
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 25

bmse001332,1543.717,1,26
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1543.717
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 26

bmse001332,1962.715,1,27
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1962.715
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 27

bmse001332,1606.546,1,28
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1606.546
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 28

bmse001332,1298.0,1,29
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1298.0
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 29

bmse001332,1658.239,1,30
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1658.239
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 30

bmse001332,2387.53,1,31
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2387.53
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 31

bmse001332,1834.677,1,32
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1834.677
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 32

bmse001332,1257.714,1,33
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1257.714
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 33

bmse001332,2594.803,1,34
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2594.803
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 34

bmse001332,2409.563,1,35
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2409.563
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 35

bmse001332,1822.142,1,36
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1822.142
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 36

bmse001332,2979.61,1,37
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2979.61
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 37

bmse001332,4527.996,1,38
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 4527.996
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 38

bmse001332,5119.096,1,39
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5119.096
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 39

bmse001332,5014.905,1,40
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5014.905
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 40

bmse001332,5689.658,1,41
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5689.658
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 41

bmse001332,4397.286,1,42
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 4397.286
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 42

bmse001332,5614.233,1,43
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5614.233
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 43

bmse001332,2152.575,1,44
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2152.575
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 44

bmse001332,1988.811,1,45
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1988.811
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 45

bmse001332,2490.112,1,46
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2490.112
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 46

bmse001332,3188.884,1,47
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 3188.884
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 47

bmse001332,1430.208,1,48
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1430.208
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 48

bmse001332,3200.965,1,49
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 3200.965
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 49

bmse001332,1882.881,1,50
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1882.881
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 50

bmse001332,1975.566,1,51
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1975.566
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 51

bmse001332,1071.97,1,52
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1071.97
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 52

bmse001332,1295.753,1,53
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1295.753
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 53

bmse001332,1013.973,1,54
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1013.973
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 54

bmse001332,1501.279,1,55
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1501.279
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 55

bmse001332,2255.566,1,56
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2255.566
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 56

bmse001332,2430.898,1,57
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2430.898
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 57

bmse001332,2160.937,1,58
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2160.937
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 58

bmse001332,2601.234,1,59
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2601.234
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 59

bmse001332,2339.784,1,60
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2339.784
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 60

bmse001332,2022.154,1,61
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2022.154
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 61

bmse001332,1853.819,1,62
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1853.819
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 62

bmse001332,1556.124,1,63
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1556.124
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 63

bmse001332,1476.034,1,64
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1476.034
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 64

bmse001332,1388.017,1,65
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1388.017
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 65

bmse001332,2098.116,1,66
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2098.116
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 66

bmse001332,1808.304,1,67
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1808.304
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 67

bmse001332,1540.134,1,68
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1540.134
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 68

bmse001332,1332.004,1,69
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1332.004
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 69

bmse001332,24.98705,1,70
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 24.98705
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 70

bmse001332,608.7702,1,71
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 608.7702
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 71

bmse001332,264.0643,1,72
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 264.0643
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 72

bmse001332,880.0461,1,73
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 880.0461
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 73

bmse001332,297.8581,1,74
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 297.8581
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 74

bmse001332,662.7828,1,75
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 662.7828
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 75

bmse001332,61.41722,1,76
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 61.41722
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 76

bmse001332,58.08892,1,77
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 58.08892
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 77

bmse001332,74.74489,1,78
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 74.74489
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 78

bmse001332,-69.99142,1,79
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: -69.99142
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 79

bmse001332,-87.4944,1,80
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: -87.4944
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 80

bmse001332,135.7192,1,81
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 135.7192
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 81

bmse001332,-566.8045,1,82
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: -566.8045
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 82

bmse001332,13264.03,1,83
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 13264.03
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 83

bmse001332,162.531,1,84
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 162.531
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 84

bmse001332,49.58735,1,85
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 49.58735
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 85

bmse001332,54.51553,1,86
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 54.51553
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 86

bmse001332,74.65443,1,87
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 74.65443
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 87

bmse001332,60.72329,1,88
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 60.72329
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 88

bmse001332,52.99954,1,89
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 52.99954
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 89

bmse001332,60.54132,1,90
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 60.54132
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 90

bmse001332,54.09667,1,91
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 54.09667
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 91

bmse001332,43.88155,1,92
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 43.88155
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 92

bmse001332,70.20641,1,93
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 70.20641
spectral transition general char.spectral peak list id: 1
spectral transition general char.spectral transition id: 93

bmse001332,8.998142,2,1
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.998142
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 1

bmse001332,8.838557,2,2
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.838557
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 2

bmse001332,6.690321,2,3
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 6.690321
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 3

bmse001332,13.90385,2,4
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 13.90385
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 4

bmse001332,10.56175,2,5
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 10.56175
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 5

bmse001332,8.586222,2,6
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.586222
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 6

bmse001332,3.607665,2,7
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 3.607665
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 7

bmse001332,8.239757,2,8
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.239757
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 8

bmse001332,4.789071,2,9
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 4.789071
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 9

bmse001332,7.684959,2,10
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 7.684959
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 10

bmse001332,10.68472,2,11
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 10.68472
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 11

bmse001332,12.58952,2,12
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 12.58952
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 12

bmse001332,10.79973,2,13
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 10.79973
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 13

bmse001332,8.259821,2,14
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.259821
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 14

bmse001332,11.31348,2,15
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 11.31348
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 15

bmse001332,8.109531,2,16
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.109531
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 16

bmse001332,8.103727,2,17
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.103727
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 17

bmse001332,12.60296,2,18
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 12.60296
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 18

bmse001332,10.63821,2,19
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 10.63821
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 19

bmse001332,5.200589,2,20
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.200589
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 20

bmse001332,5.428337,2,21
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.428337
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 21

bmse001332,13.02593,2,22
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 13.02593
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 22

bmse001332,4.744602,2,23
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 4.744602
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 23

bmse001332,5.583005,2,24
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.583005
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 24

bmse001332,8.003615,2,25
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.003615
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 25

bmse001332,10.2966,2,26
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 10.2966
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 26

bmse001332,6.644813,2,27
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 6.644813
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 27

bmse001332,11.91921,2,28
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 11.91921
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 28

bmse001332,9.576062,2,29
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 9.576062
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 29

bmse001332,5.305758,2,30
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.305758
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 30

bmse001332,3.632754,2,31
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 3.632754
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 31

bmse001332,7.506138,2,32
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 7.506138
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 32

bmse001332,10.94356,2,33
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 10.94356
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 33

bmse001332,15.0,2,34
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 15.0
spectral transition general char.spectral peak list id: 2
spectral transition general char.spectral transition id: 34

bmse001332,8.522068,3,1
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.522068
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 1

bmse001332,7.155214,3,2
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 7.155214
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 2

bmse001332,15.0,3,3
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 15.0
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 3

bmse001332,12.85842,3,4
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 12.85842
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 4

bmse001332,9.034762,3,5
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 9.034762
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 5

bmse001332,4.613825,3,6
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 4.613825
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 6

bmse001332,8.674044,3,7
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.674044
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 7

bmse001332,4.669008,3,8
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 4.669008
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 8

bmse001332,7.711084,3,9
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 7.711084
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 9

bmse001332,11.32115,3,10
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 11.32115
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 10

bmse001332,13.77729,3,11
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 13.77729
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 11

bmse001332,11.96192,3,12
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 11.96192
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 12

bmse001332,8.987143,3,13
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.987143
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 13

bmse001332,12.38195,3,14
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 12.38195
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 14

bmse001332,8.0631,3,15
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.0631
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 15

bmse001332,9.541569,3,16
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 9.541569
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 16

bmse001332,12.73527,3,17
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 12.73527
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 17

bmse001332,11.0706,3,18
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 11.0706
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 18

bmse001332,5.332052,3,19
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.332052
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 19

bmse001332,5.78997,3,20
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.78997
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 20

bmse001332,13.87793,3,21
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 13.87793
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 21

bmse001332,5.679533,3,22
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.679533
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 22

bmse001332,5.686106,3,23
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.686106
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 23

bmse001332,9.030655,3,24
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 9.030655
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 24

bmse001332,13.68459,3,25
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 13.68459
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 25

bmse001332,6.156349,3,26
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 6.156349
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 26

bmse001332,9.210808,3,27
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 9.210808
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 27

bmse001332,11.84019,3,28
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 11.84019
spectral transition general char.spectral peak list id: 3
spectral transition general char.spectral transition id: 28

bmse001332,6.364982,4,1
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 6.364982
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 1

bmse001332,5.197507,4,2
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.197507
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 2

bmse001332,12.85678,4,3
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 12.85678
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 3

bmse001332,9.863581,4,4
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 9.863581
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 4

bmse001332,8.030448,4,5
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.030448
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 5

bmse001332,3.761101,4,6
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 3.761101
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 6

bmse001332,6.893756,4,7
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 6.893756
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 7

bmse001332,5.376833,4,8
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.376833
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 8

bmse001332,3.763984,4,9
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 3.763984
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 9

bmse001332,6.975425,4,10
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 6.975425
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 10

bmse001332,9.016712,4,11
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 9.016712
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 11

bmse001332,11.4044,4,12
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 11.4044
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 12

bmse001332,9.200718,4,13
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 9.200718
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 13

bmse001332,8.423786,4,14
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.423786
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 14

bmse001332,10.74466,4,15
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 10.74466
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 15

bmse001332,6.305672,4,16
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 6.305672
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 16

bmse001332,9.120181,4,17
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 9.120181
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 17

bmse001332,10.3933,4,18
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 10.3933
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 18

bmse001332,8.672841,4,19
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.672841
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 19

bmse001332,5.061434,4,20
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.061434
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 20

bmse001332,5.45728,4,21
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.45728
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 21

bmse001332,12.34594,4,22
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 12.34594
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 22

bmse001332,5.25293,4,23
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.25293
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 23

bmse001332,4.15208,4,24
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 4.15208
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 24

bmse001332,7.116521,4,25
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 7.116521
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 25

bmse001332,11.9514,4,26
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 11.9514
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 26

bmse001332,4.167764,4,27
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 4.167764
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 27

bmse001332,7.177855,4,28
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 7.177855
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 28

bmse001332,-15.0,4,29
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: -15.0
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 29

bmse001332,-9.595058,4,30
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: -9.595058
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 30

bmse001332,-6.02766,4,31
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: -6.02766
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 31

bmse001332,-4.901046,4,32
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: -4.901046
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 32

bmse001332,-9.519865,4,33
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: -9.519865
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 33

bmse001332,10.2546,4,34
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 10.2546
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 34

bmse001332,12.70842,4,35
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 12.70842
spectral transition general char.spectral peak list id: 4
spectral transition general char.spectral transition id: 35

bmse001332,129773.0,5,1
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 129773.0
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 1

bmse001332,103416.5,5,2
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 103416.5
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 2

bmse001332,126870.3,5,3
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 126870.3
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 3

bmse001332,70434.95,5,4
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 70434.95
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 4

bmse001332,43664.69,5,5
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 43664.69
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 5

bmse001332,103703.4,5,6
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 103703.4
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 6

bmse001332,105162.2,5,7
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 105162.2
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 7

bmse001332,98556.76,5,8
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 98556.76
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 8

bmse001332,96412.57,5,9
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 96412.57
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 9

bmse001332,157163.8,5,10
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 157163.8
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 10

bmse001332,75066.67,5,11
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 75066.67
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 11

bmse001332,82440.31,5,12
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 82440.31
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 12

bmse001332,103756.8,5,13
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 103756.8
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 13

bmse001332,102987.9,5,14
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 102987.9
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 14

bmse001332,44345.38,5,15
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 44345.38
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 15

bmse001332,107046.5,5,16
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 107046.5
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 16

bmse001332,76127.74,5,17
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 76127.74
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 17

bmse001332,49639.76,5,18
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 49639.76
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 18

bmse001332,154196.8,5,19
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 154196.8
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 19

bmse001332,171150.7,5,20
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 171150.7
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 20

bmse001332,404815.6,5,21
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 404815.6
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 21

bmse001332,63917.76,5,22
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 63917.76
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 22

bmse001332,177094.4,5,23
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 177094.4
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 23

bmse001332,170126.9,5,24
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 170126.9
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 24

bmse001332,77838.12,5,25
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 77838.12
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 25

bmse001332,341550.7,5,26
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 341550.7
spectral transition general char.spectral peak list id: 5
spectral transition general char.spectral transition id: 26

bmse001332,0.03652937,6,1
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.03652937
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 1

bmse001332,0.1201204,6,2
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1201204
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 2

bmse001332,0.06510026,6,3
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.06510026
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 3

bmse001332,0.1283165,6,4
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1283165
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 4

bmse001332,0.05959271,6,5
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.05959271
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 5

bmse001332,0.06217747,6,6
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.06217747
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 6

bmse001332,0.1633189,6,7
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1633189
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 7

bmse001332,0.1659846,6,8
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1659846
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 8

bmse001332,0.1528696,6,9
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1528696
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 9

bmse001332,0.1471078,6,10
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1471078
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 10

bmse001332,0.1716221,6,11
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1716221
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 11

bmse001332,0.0531228,6,12
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.0531228
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 12

bmse001332,0.05517134,6,13
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.05517134
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 13

bmse001332,0.05593734,6,14
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.05593734
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 14

bmse001332,0.09001647,6,15
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.09001647
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 15

bmse001332,0.067319,6,16
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.067319
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 16

bmse001332,0.07489449,6,17
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.07489449
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 17

bmse001332,0.08442937,6,18
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.08442937
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 18

bmse001332,0.08028923,6,19
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.08028923
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 19

bmse001332,0.06999583,6,20
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.06999583
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 20

bmse001332,0.08652796,6,21
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.08652796
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 21

bmse001332,0.05508643,6,22
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.05508643
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 22

bmse001332,0.04682478,6,23
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.04682478
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 23

bmse001332,0.08507341,6,24
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.08507341
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 24

bmse001332,0.05617206,6,25
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.05617206
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 25

bmse001332,0.1341656,6,26
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1341656
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 26

bmse001332,0.1320033,6,27
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1320033
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 27

bmse001332,0.07030109,6,28
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.07030109
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 28

bmse001332,0.1451023,6,29
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1451023
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 29

bmse001332,0.07772319,6,30
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.07772319
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 30

bmse001332,0.1644697,6,31
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1644697
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 31

bmse001332,0.1724514,6,32
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1724514
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 32

bmse001332,0.03419652,6,33
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.03419652
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 33

bmse001332,0.1293284,6,34
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1293284
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 34

bmse001332,0.1394326,6,35
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1394326
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 35

bmse001332,0.03661829,6,36
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.03661829
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 36

bmse001332,0.03957264,6,37
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.03957264
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 37

bmse001332,0.1070862,6,38
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1070862
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 38

bmse001332,0.1208884,6,39
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1208884
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 39

bmse001332,0.11321,6,40
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.11321
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 40

bmse001332,0.1049422,6,41
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1049422
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 41

bmse001332,0.1212364,6,42
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1212364
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 42

bmse001332,0.1125484,6,43
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1125484
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 43

bmse001332,0.1192921,6,44
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1192921
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 44

bmse001332,0.1159732,6,45
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1159732
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 45

bmse001332,0.0559837,6,46
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.0559837
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 46

bmse001332,0.07644131,6,47
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.07644131
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 47

bmse001332,0.09400451,6,48
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.09400451
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 48

bmse001332,0.08992845,6,49
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.08992845
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 49

bmse001332,0.07328761,6,50
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.07328761
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 50

bmse001332,0.1170002,6,51
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1170002
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 51

bmse001332,0.0780567,6,52
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.0780567
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 52

bmse001332,0.06539206,6,53
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.06539206
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 53

bmse001332,0.1100892,6,54
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1100892
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 54

bmse001332,0.07920986,6,55
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.07920986
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 55

bmse001332,0.1335724,6,56
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1335724
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 56

bmse001332,0.1974115,6,57
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1974115
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 57

bmse001332,0.1871868,6,58
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1871868
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 58

bmse001332,0.1307272,6,59
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1307272
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 59

bmse001332,0.2067872,6,60
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.2067872
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 60

bmse001332,0.2116702,6,61
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.2116702
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 61

bmse001332,0.09578769,6,62
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.09578769
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 62

bmse001332,0.09539679,6,63
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.09539679
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 63

bmse001332,0.1623394,6,64
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1623394
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 64

bmse001332,0.1836605,6,65
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1836605
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 65

bmse001332,0.1804941,6,66
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1804941
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 66

bmse001332,0.2162169,6,67
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.2162169
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 67

bmse001332,0.2234376,6,68
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.2234376
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 68

bmse001332,0.2996041,6,69
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.2996041
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 69

bmse001332,0.4164382,6,70
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.4164382
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 70

bmse001332,0.3676999,6,71
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.3676999
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 71

bmse001332,0.299257,6,72
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.299257
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 72

bmse001332,0.3132327,6,73
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.3132327
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 73

bmse001332,0.3198946,6,74
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.3198946
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 74

bmse001332,0.2388262,6,75
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.2388262
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 75

bmse001332,0.3650562,6,76
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.3650562
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 76

bmse001332,0.2050529,6,77
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.2050529
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 77

bmse001332,0.1939494,6,78
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1939494
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 78

bmse001332,0.0863956,6,79
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.0863956
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 79

bmse001332,0.1006265,6,80
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1006265
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 80

bmse001332,0.08133714,6,81
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.08133714
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 81

bmse001332,0.08585163,6,82
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.08585163
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 82

bmse001332,0.07089608,6,83
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.07089608
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 83

bmse001332,0.07023989,6,84
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.07023989
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 84

bmse001332,0.06906067,6,85
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.06906067
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 85

bmse001332,0.2158764,6,86
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.2158764
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 86

bmse001332,0.1926836,6,87
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1926836
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 87

bmse001332,0.1925186,6,88
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1925186
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 88

bmse001332,0.4182186,6,89
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.4182186
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 89

bmse001332,0.4269114,6,90
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.4269114
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 90

bmse001332,0.5006687,6,91
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.5006687
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 91

bmse001332,0.2205793,6,92
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.2205793
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 92

bmse001332,0.07824137,6,93
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.07824137
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 93

bmse001332,0.07545002,6,94
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.07545002
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 94

bmse001332,0.08130956,6,95
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.08130956
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 95

bmse001332,0.1033647,6,96
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1033647
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 96

bmse001332,0.0794809,6,97
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.0794809
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 97

bmse001332,0.07108634,6,98
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.07108634
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 98

bmse001332,0.06805397,6,99
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.06805397
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 99

bmse001332,0.07613961,6,100
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.07613961
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 100

bmse001332,0.1774802,6,101
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1774802
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 101

bmse001332,0.2533171,6,102
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.2533171
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 102

bmse001332,0.1988211,6,103
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1988211
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 103

bmse001332,0.1100741,6,104
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1100741
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 104

bmse001332,0.03485832,6,105
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.03485832
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 105

bmse001332,1.306733,6,106
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1.306733
spectral transition general char.spectral peak list id: 6
spectral transition general char.spectral transition id: 106

bmse001332,0.1414237,7,1
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1414237
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 1

bmse001332,0.1701753,7,2
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1701753
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 2

bmse001332,0.1228459,7,3
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1228459
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 3

bmse001332,0.04463725,7,4
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.04463725
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 4

bmse001332,0.1205259,7,5
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1205259
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 5

bmse001332,0.039931,7,6
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.039931
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 6

bmse001332,0.1098927,7,7
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1098927
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 7

bmse001332,0.03811971,7,8
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.03811971
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 8

bmse001332,0.1185307,7,9
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1185307
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 9

bmse001332,0.1370377,7,10
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1370377
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 10

bmse001332,0.1300176,7,11
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1300176
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 11

bmse001332,0.0358607,7,12
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.0358607
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 12

bmse001332,0.1885165,7,13
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1885165
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 13

bmse001332,0.1384622,7,14
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1384622
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 14

bmse001332,0.04125267,7,15
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.04125267
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 15

bmse001332,0.1449464,7,16
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1449464
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 16

bmse001332,0.04620788,7,17
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.04620788
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 17

bmse001332,0.04018306,7,18
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.04018306
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 18

bmse001332,0.1795438,7,19
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1795438
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 19

bmse001332,0.2491889,7,20
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.2491889
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 20

bmse001332,0.1375106,7,21
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1375106
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 21

bmse001332,0.179307,7,22
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.179307
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 22

bmse001332,0.1381446,7,23
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1381446
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 23

bmse001332,0.1244798,7,24
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1244798
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 24

bmse001332,0.1481039,7,25
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1481039
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 25

bmse001332,0.1181821,7,26
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1181821
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 26

bmse001332,0.2965396,7,27
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.2965396
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 27

bmse001332,0.1490789,7,28
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1490789
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 28

bmse001332,0.2060182,7,29
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.2060182
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 29

bmse001332,0.1323347,7,30
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.1323347
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 30

bmse001332,0.2357088,7,31
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 0.2357088
spectral transition general char.spectral peak list id: 7
spectral transition general char.spectral transition id: 31

bmse001332,10.27897,8,1
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 10.27897
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 1

bmse001332,7.63904,8,2
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 7.63904
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 2

bmse001332,2.540918,8,3
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2.540918
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 3

bmse001332,7.477351,8,4
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 7.477351
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 4

bmse001332,2.379427,8,5
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2.379427
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 5

bmse001332,7.355591,8,6
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 7.355591
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 6

bmse001332,2.22549,8,7
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2.22549
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 7

bmse001332,7.104695,8,8
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 7.104695
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 8

bmse001332,8.198834,8,9
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.198834
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 9

bmse001332,7.620016,8,10
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 7.620016
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 10

bmse001332,2.010049,8,11
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2.010049
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 11

bmse001332,10.91025,8,12
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 10.91025
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 12

bmse001332,8.580293,8,13
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.580293
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 13

bmse001332,2.337508,8,14
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2.337508
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 14

bmse001332,8.838253,8,15
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.838253
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 15

bmse001332,2.45075,8,16
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2.45075
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 16

bmse001332,2.414877,8,17
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 2.414877
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 17

bmse001332,10.51081,8,18
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 10.51081
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 18

bmse001332,15.0,8,19
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 15.0
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 19

bmse001332,8.641385,8,20
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.641385
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 20

bmse001332,10.72994,8,21
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 10.72994
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 21

bmse001332,8.70557,8,22
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.70557
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 22

bmse001332,7.692112,8,23
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 7.692112
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 23

bmse001332,3.152541,8,24
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 3.152541
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 24

bmse001332,10.18494,8,25
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 10.18494
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 25

bmse001332,8.292283,8,26
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 8.292283
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 26

bmse001332,7.978619,8,27
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 7.978619
spectral transition general char.spectral peak list id: 8
spectral transition general char.spectral transition id: 27

bmse001332,7.409506,9,1
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 7.409506
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 1

bmse001332,4.930624,9,2
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 4.930624
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 2

bmse001332,1.719748,9,3
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1.719748
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 3

bmse001332,4.891306,9,4
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 4.891306
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 4

bmse001332,1.60412,9,5
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1.60412
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 5

bmse001332,4.784812,9,6
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 4.784812
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 6

bmse001332,1.353845,9,7
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1.353845
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 7

bmse001332,4.670166,9,8
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 4.670166
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 8

bmse001332,5.096794,9,9
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.096794
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 9

bmse001332,5.04064,9,10
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.04064
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 10

bmse001332,1.341165,9,11
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1.341165
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 11

bmse001332,7.496213,9,12
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 7.496213
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 12

bmse001332,5.790243,9,13
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.790243
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 13

bmse001332,1.539436,9,14
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1.539436
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 14

bmse001332,5.804903,9,15
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.804903
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 15

bmse001332,1.550567,9,16
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1.550567
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 16

bmse001332,1.727738,9,17
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1.727738
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 17

bmse001332,7.486075,9,18
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 7.486075
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 18

bmse001332,9.777244,9,19
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 9.777244
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 19

bmse001332,6.194811,9,20
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 6.194811
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 20

bmse001332,7.675173,9,21
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 7.675173
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 21

bmse001332,6.213667,9,22
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 6.213667
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 22

bmse001332,5.340522,9,23
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.340522
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 23

bmse001332,1.832798,9,24
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 1.832798
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 24

bmse001332,6.897228,9,25
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 6.897228
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 25

bmse001332,5.378911,9,26
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.378911
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 26

bmse001332,-14.30837,9,27
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: -14.30837
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 27

bmse001332,-8.12422,9,28
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: -8.12422
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 28

bmse001332,-8.085421,9,29
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: -8.085421
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 29

bmse001332,-10.16345,9,30
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: -10.16345
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 30

bmse001332,5.082582,9,31
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 5.082582
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 31

bmse001332,15.0,9,32
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 15.0
spectral transition general char.spectral peak list id: 9
spectral transition general char.spectral transition id: 32

bmse001332,109717.4,10,1
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 109717.4
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 1

bmse001332,114500.7,10,2
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 114500.7
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 2

bmse001332,103415.2,10,3
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 103415.2
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 3

bmse001332,29338.89,10,4
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 29338.89
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 4

bmse001332,88893.67,10,5
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 88893.67
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 5

bmse001332,108916.4,10,6
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 108916.4
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 6

bmse001332,178009.1,10,7
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 178009.1
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 7

bmse001332,170156.0,10,8
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 170156.0
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 8

bmse001332,97129.11,10,9
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 97129.11
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 9

bmse001332,129347.0,10,10
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 129347.0
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 10

bmse001332,86571.98,10,11
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 86571.98
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 11

bmse001332,76964.01,10,12
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 76964.01
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 12

bmse001332,80920.50,10,13
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 80920.50
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 13

bmse001332,153175.8,10,14
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 153175.8
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 14

bmse001332,89278.15,10,15
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 89278.15
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 15

bmse001332,133341.4,10,16
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 133341.4
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 16

bmse001332,106277.7,10,17
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 106277.7
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 17

bmse001332,127744.6,10,18
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 127744.6
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 18

bmse001332,334093.2,10,19
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 334093.2
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 19

bmse001332,262379.1,10,20
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 262379.1
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 20

bmse001332,136293.5,10,21
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 136293.5
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 21

bmse001332,391880.0,10,22
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 391880.0
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 22

bmse001332,75547.59,10,23
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 75547.59
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 23

bmse001332,316452.6,10,24
type: spectral transition general char
of datablock: info:bmrb.metabolomics/bmse001332
spectral transition general char.entry id: bmse001332
spectral transition general char.intensity val: 316452.6
spectral transition general char.spectral peak list id: 10
spectral transition general char.spectral transition id: 24

bmse001332,1,atom nomenclature correction
type: task
of datablock: info:bmrb.metabolomics/bmse001332
task.entry id: bmse001332
task.software id: 1
task.task: atom nomenclature correction

bmse001332,2,collection
type: task
of datablock: info:bmrb.metabolomics/bmse001332
task.entry id: bmse001332
task.software id: 2
task.task: collection

bmse001332,3,collection
type: task
of datablock: info:bmrb.metabolomics/bmse001332
task.entry id: bmse001332
task.software id: 3
task.task: collection

bmse001332,3,data analysis
type: task
of datablock: info:bmrb.metabolomics/bmse001332
task.entry id: bmse001332
task.software id: 3
task.task: data analysis

bmse001332,3,peak picking
type: task
of datablock: info:bmrb.metabolomics/bmse001332
task.entry id: bmse001332
task.software id: 3
task.task: peak picking

bmse001332,3,processing
type: task
of datablock: info:bmrb.metabolomics/bmse001332
task.entry id: bmse001332
task.software id: 3
task.task: processing

bmse001332,NMRFAM,1
type: vendor
of datablock: info:bmrb.metabolomics/bmse001332
vendor.entry id: bmse001332
vendor.name: NMRFAM
vendor.software id: 1
vendor.electronic address: http://alatis.nmrfam.wisc.edu/

bmse001332,NMRFAM,2
type: vendor
of datablock: info:bmrb.metabolomics/bmse001332
vendor.entry id: bmse001332
vendor.name: NMRFAM
vendor.software id: 2
vendor.electronic address: http://www.nmrfam.wisc.edu/software/nmrbot/

bmse001332,Bruker Biospin,3
type: vendor
of datablock: info:bmrb.metabolomics/bmse001332
vendor.entry id: bmse001332
vendor.name: Bruker Biospin
vendor.software id: 3
vendor.electronic address: http://www.bruker.com/products/mr/nmr/nmr-software/software/topspin/