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Analysis: Normal phase NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
2_3-Diphosphoglyceric acid2,3-Diphosphoglyceric acidME274031---264.952
2-dehydro-D-gluconate2-Dehydro-D-gluconic acidME274032---193.0354
2-Hydroxy-2-methylbutanedioic acidCitramalic acidME274033---147.03385
2-oxo-4-methylthiobutanoate2-Oxo-4-methylthiobutanoic acidME274034---149.0267
3-phosphoglycerate3-Phosphoglyceric acidME274035---184.9857
3-phospho-serinePhosphoserineME274036---184.0017
4-aminobutyrategamma-Aminobutyric acidME274037---102.0561
4-phosphopantetheinePantetheine 4'-phosphateME274038---357.089
4-phosphopantothenate(R)-4'-Phosphopantothenic acidME274039---300.08429
4-Pyridoxic acid4-Pyridoxic acidME274040---182.0459
5-phosphoribosyl-1-pyrophosphatePhosphoribosyl pyrophosphateME274041---388.9446
6-phospho-D-gluconate6-Phosphogluconic acidME274042---275.0174
acetyl-aspartateN-Acetylaspartic acidME274043---174.0408
acetyl-CoAAcetyl-CoAME274044---808.1184
AcetyllysineN(2)-AcetyllysineME274045---187.1088
aconitatetrans-Aconitic acidME274046---173.0092
ADP-D-glucoseADP-glucoseME274047---588.075
a-ketoglutarate2-Oxoglutaric acidME274048---145.0143
alanine/sarcosineAlanine/SarcosineME274049---88.0404
arginineArginineME274050---173.1044
asparagineAsparagineME274051---131.0462
aspartateAspartic acidME274052---132.0302
carnitineCarnitineME274053---162.1125
CDPCDPME274054---402.0109
CDP-cholineCDP-cholineME274055---487.1
CDP-ethanolamineCDP-EthanolamineME274056---445.0531
citrate/isocitrateCitric acid/Isocitric acidME274057---191.0197
CMPCMPME274058---322.0446
coenzyme ACoenzyme AME274059---766.108
CTPCTPME274060---481.9772
cyclic-AMP3',5' cyclic AMPME274061---328.0452
cytidineCytidineME274062---242.0782
dAMPdAMPME274063---330.0609
dATPdATPME274064---489.9936
dCDPdCDPME274065---386.016
dCMPdCMPME274066---306.0497
dCTPdCTPME274067---465.9823
deoxyinosineDeoxyinosineME274068---253.0931
deoxyribose-phosphateDeoxyribose 5-phosphateME274069---215.0315
dGDP/ADPADPME274070---426.0222
D-gluconateGluconic acidME274071---195.051
dGMP/AMPdGMPME274072---346.0558
dGTP/ATPATPME274073---505.9885
dihydroorotate4,5-Dihydroorotic acidME274074---157.0255
dihydroxy-acetone-phosphateDihydroxyacetone phosphateME274075---168.9908
DLHAsp-Leu-HisME274076---382.1732
DL-Pipecolic AcidPipecolic acidME274077---128.0717
DLSAsp-Leu-SerME274078---332.1463
D-sedoheptulose-1/7-phosphate-ME274079---289.033
dTDPdTDPME274080---401.0157
dTMPdTMPME274081---321.0493
dTTPdTTPME274082---480.982
dUMPdUMPME274083---309.0482
dUTPdUTPME274084---466.9663
FADFADME274085---784.1499
FMNFMNME274086---455.0973
folateFolic acidME274087---440.1324
fructose-1-6-bisphosphateFructose 1,6-bisphosphateME274088---338.9888
fructose-6-phosphateFructose 6-phosphateME274089---259.0225
fumarateFumaric acidME274090---115.0037
GDPGDPME274091---442.017
glucono-lactoneGluconolactoneME274092---177.0405
glucose-1/6-phosphate-ME274093---261.037
glutamateGlutamic acidME274094---146.0459
glutamineGlutamineME274095---145.0619
glutathione disulfideOxidized glutathioneME274096---611.1447
glycerateGlyceric acidME274097---105.0193
GMPGMPME274098---362.0507
GTPGTPME274099---521.9834
guanineGuanineME274100---150.0421
guanosineGuanosineME274101---282.0844
histidineHistidineME274102---154.0622
HVDD-ME274103---484.1923
hydroxyproline/Aminolevulinatecis-3-HydroxyprolineME274104---130.051
hypoxanthineHypoxanthineME274105---135.0312
IMPIMPME274106---347.0398
indoleIndoleME274107---118.0651
inosineInosineME274108---267.0735
isoleucineIsoleucineME274109---130.0874
Isopentyl-PP-ME274110---317.0925
lactateLactic acidME274111---89.0244
L-arginino-succinateArgininosuccinic acidME274112---289.1154
LD-ME274113---245.1143
leucineLeucineME274114---130.0874
lysineLysineME274115---145.0983
malateMalic acidME274116---133.0142
maleic acidMaleic acidME274117---115.0037
methionineMethionineME274118---148.0438
myo-inositolMyo-inositolME274119---179.0561
Myristoyl/tetradecanoyl-CoAMyristoyl-CoAME274120---976.3063
N-acetyl-glucosamine-1/6-phosphate-ME274121---300.049
N-acetyl-glutamateN-Acetylglutamic acidME274122---188.0564
N-acetyl-glutamineN-AcetylglutamineME274123---187.0724
N-Acetyl-L-alanineN-AcetylalanineME274124---130.051
N-acetyl-L-ornithineN-AcetylornithineME274125---173.0932
NAD+NAD+ME274126---662.1019
NADHNADHME274127---664.1175
NADP+NADP+ME274128---742.0682
NADPHNADPHME274129---744.0838
N-carbamoyl-L-aspartateCarbamoylaspartateME274130---175.036
nicotinamide mononucleotideNicotinamide ribotideME274131---333.0493
nicotinateNicotinic acidME274132---122.0248
Octulose 8/1P-ME274133---319.0436
Octulose Bisphosphate-ME274134---399.0099
ornithineOrnithineME274135---133.0972
orotateOrotic acidME274136---155.0098
orotidine-5'-phosphateOrotidylic acidME274137---367.0184
pantothenatePantothenic acidME274138---218.1034
PDPro-AspME274139---229.083
PE-ME274140---243.0986
PEEPro-Glu-GluME274141---372.1412
PEEK-ME274142---500.2362
phenylalaninePhenylalanineME274143---164.0717
phenylpyruvatePhenylpyruvic acidME274144---165.0546
phosphoenolpyruvatePhosphoenolpyruvic acidME274145---166.9751
p-hydroxybenzoate4-Hydroxybenzoic acidME274146---139.039
prolineProlineME274147---114.0561
PVNFPro-Val-Asn-PheME274148---474.2358
pyridoxinePyridoxineME274149---168.0666
Pyroglutamic acidPyroglutamic acidME274150---128.0353
PyrophosphatePyrophosphateME274151---178.9505
pyruvatePyruvic acidME274152---87.0088
Ribose-5-phosphateRibose 5-phosphateME274153---229.0119
ribose-phosphateRibose 5-phosphateME274154---229.0119
ribulose-5-phosphateRibulose 5-phosphateME274155---229.0119
S-adenosyl-L-homocysteineS-AdenosylhomocysteineME274156---383.1143
SDSer-AspME274157---219.0623
SDL-ME274158---332.1463
Sedoheptulose bisphosphateSedoheptulose 1,7-bisphosphateME274159---368.9994
serineSerineME274160---104.0353
SID-ME274161---332.1463
S-methyl-5'-thioadenosine5'-MethylthioadenosineME274162---296.0823
sn-glycerol-3-phosphatesn-Glycero-3-phosphateME274163---171.0064
succinate/Methylmalonic acidMethylmalonic acidME274164---117.0193
succinyl-CoA/methylmalonyl-CoA-ME274165---866.124
taurineTaurineME274166---124.0074
thiamineThiamineME274167---263.0972
Thiamine pyrophosphateThiamine diphosphateME274168---423.0299
threonine/homoserineThreonine/HomoserineME274169---118.051
thymidineThymidineME274170---243.0975
thymineThymineME274171---127.0502
trehalose-6-PhosphateTrehalose 6-phosphateME274172---421.0753
tryptophanTryptophanME274173---203.0826
tyrosineTyrosineME274174---180.0666
UDPUDPME274175---402.9949
UDP-D-glucoseUDP-glucoseME274176---565.0478
UDP-D-glucuronateUDP-glucuronic acidME274177---579.027
UDP-N-acetyl-glucosamineUDP-N-acetylglucosamineME274178---606.0743
UMPUMPME274179---323.0286
uridineUridineME274180---245.0768
UTPUTPME274181---482.9613
valineValineME274182---116.0717
VD-ME274183---231.0986
xanthineXanthineME274184---153.0407
xanthosineXanthosineME274185---283.0684
xanthosine-5-phosphateXMPME274186---363.0347


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