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Analysis: HILIC NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
1,3-Bisphosphoglyceric acid3-Phospho-D-glyceroyl dihydrogen phosphateME399340--5.27-
2-Deoxy-D-Ribose2-Deoxy-riboseME399322--4.05-
2-Hydroxyglutaric acid2-Hydroxyglutaric acidME399316--4.75-
3-Phosphoglycerate (PGA)--2-PGAPhosphoglyceric acidME399359--4.78-
6-Phosphogluconic acid6-Phosphogluconic acidME399336--4.9-
9-O-Acetylneuraminic acid-ME399343--4.22-
AdenosineAdenosineME399292--4.09-
ADPADPME399279--4.5-
ADP-D-riboseADP-riboseME399274--4.58-
aKG_oxoglutarate2-Oxoglutaric acidME399360--4.21-
AMPAMPME399282--4.62-
BetaineBetaineME399361--4.24-
cADP-ribose-ME399275--4.7-
cAMP3',5' cyclic AMPME399285--4.47-
Citric acidCitric acidME399306--7.19-
CitrullineCitrullineME399309--4.61-
CMP-N-acetylneuraminateCMP-N-acetylneuraminic acidME399269--4.95-
CreatineCreatineME399327--4.49-
Cysteine isoCysteineME399337--5.2-
CystineCystineME399308--4.47-
CytidineCytidineME399299--4.61-
Cytidine diphosphate (CDP)CDPME399280--4.48-
D-4-Hydroxy-2-oxoglutarate4-Hydroxy-2-oxoglutaric acidME399345--3.07-
dAMP_Deoxyadenosine monophosphatedAMPME399284--4.82-
D-Arabinose 5-phosphate-ME399344--4.67-
dCMPdCMPME399290--3.7-
DeoxyuridineDeoxyuridineME399303--4.58-
D-Fructose 1,6-bisphosphateFructose 1,6-bisphosphateME399342--4.56-
D-GlucoseGlucoseME399347--4.25-
D-Glucose 1,6-bisphosphate-ME399283--5-
D-Glycerate 2-phosphate2-Phosphoglyceric acidME399307--4.78-
DHAP_Dihydroacetone phosphateDihydroxyacetone phosphateME399339--1.16-
Dihydroxymandelate iso_-ME399294--4.08-
D-Ribose 5-phosphateRibose 5-phosphateME399302--4.67-
D-Sedoheptulose 7-phosphateD-Sedoheptulose 7-phosphateME399338--4.75-
dTMPdTMPME399287--4.49-
dUMP_deoxyuridine monophosphate isodUMPME399363--4.01-
FAD, Flavin adenine dinucleotideFADME399265--4.61-
FolateFolic acidME399364--4.58-
FumarateFumaric acidME399330--4.67-
GABA_y-Aminobutryic acidgamma-Aminobutyric acidME399333--4.62-
GDP, Guanosine diphosphateGDPME399277--4.51-
Gly_GlycineGlycineME399348--4.58-
GMP (guanosine monophosphate)GMPME399281--4.73-
GSH, GlutathioneGlutathioneME399289--4.62-
GSSG, Glutathione oxidizedGlutathioneME399270--4.95-
GuanineGuanineME399314--4.23-
Guanosine IIGuanosineME399341--4.15-
HNE, Hydroxynonenal4-HydroxynonenalME399297--1.28-
HomocysteineHomocysteineME399349--4.09-
Hypotaurine isoHypotaurineME399332--4.48-
HypoxanthineHypoxanthineME399321--2.74-
IDP, Inosine diphosphateIDPME399278--4.45-
InosineInosineME399291--3.78-
L-AcetylcarnitineCAR 2:0ME399305--2.02-
LactateLactic acidME399334--3.99-
L-ArginineArginineME399311--5.08-
L-AsparagineAsparagineME399326--4.66-
L-AspartateAspartic acidME399324--4.69-
L-GlutamateGlutamic acidME399317--4.62-
L-GlutamineGlutamineME399320--4.58-
L-HistidineHistidineME399313--5.12-
L-LysineLysineME399319--5.08-
L-OrnithineOrnithineME399325--5.09-
L-Ornithine_isoOrnithineME399318--4.61-
L-PhenylalaninePhenylalanineME399296--4.13-
L-SerineSerineME399355--4.64-
L-ValineValineME399358--4.24-
MalateMalic acidME399323--4.76-
MethionineMethionineME399350--4.22-
Methoxy-4-hydroxyphenylglycolaldehyde I-ME399295--3.52-
MevalonateMevalonic acidME399315--3.95-
Mevalonate pyrophosphate (Mevalonate-5PP)-ME399288--4.46-
N2-Acetyl-L-ornithineN-AcetylornithineME399312--4.5-
N6,N6-DimethyladenosineN(6),N(6)-DimethyladenosineME399362--4.47-
N-Acetylaspartate_NAAN-Acetylaspartic acidME399310--4.56-
N-Acetylcysteine (NAC) mainN-AcetylcysteineME399351--3.92-
N-Acetylcysteine (NAC) main_isoN-AcetylcysteineME399356--4.81-
N-acetylglucosamine.HCl, order 1x moreN-Acetyl-D-glucosamineME399353--4.1-
NAD cationNAD+ME399268--4.7-
NADHNADHME399267--4.6-
NADP cationNADP+ME399266--4.88-
N-Succinyl-L-glutamate 5-semialdehyde-ME399301--4.56-
Oxaloacetate-CO2,87Oxaloacetic acidME399352--4.24-
PantothenatePantothenic acidME399304--3.95-
Phosphenopyruvate (PEP), NIBPhosphoenolpyruvic acidME399354--4.75-
PyruvatePyruvic acidME399335--2.58-
Pyruvate_Pyruvic acidME399346--2.6-
SuccinateSuccinic acidME399329--4.1-
TaurineTaurineME399328--4.23-
Thiamine cationThiamineME399293--4.54-
Thymidine isoThymidineME399300--1.93-
TMP_Thymidine monophosphate isoTMPME399357--4.49-
UDP-D-galacturonate-ME399272--4.93-
UDP-D-XyloseUDP-D-XyloseME399276--4.52-
UDP-glucoseUDP-glucoseME399273--4.75-
UDP-N-acetylglucosamineUDP-N-acetylglucosamineME399271--4.69-
UMPUMPME399286--4.77-
UracilUracilME399331--1.97-
y-Glu-Cys isogamma-GlutamylcysteineME399298--4.26-


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