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Analysis: HILIC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
5-Glutamyl-alaninegamma-GlutamylalanineME268235----
AcetylaspartateN-Acetylaspartic acidME268208----
AcetylglutamateN-Acetylglutamic acidME268210----
AlanineAlanineME268212----
Alpha-N-Phenylacetylglutaminealpha-N-PhenylacetylglutamineME268259----
Aminoadipic acidAminoadipic acidME268213----
ArginineArginineME268214----
AsparagineAsparagineME268215----
Beta-Alaninebeta-AlanineME268217----
BetaineBetaineME268218----
BiotinBiotinME268219----
CAR(2:0)CAR 2:0ME268209----
CarnitineCarnitineME268220----
CarnosineCarnosineME268221----
CDP-cholineCDP-cholineME268222----
CholineCholineME268223----
Choline phosphateCholine phosphateME268261----
CitrullineCitrullineME268224----
CMPCMPME268225----
Coenzyme ACoenzyme AME268226----
CreatinineCreatinineME268227----
CystathionineCystathionineME268228----
CystineCystineME268229----
CytidineCytidineME268230----
dATPdATPME268231----
DeoxycytidineDeoxycytidineME268232----
DimethylarginineDimethylarginineME268216----
Fructose-1,6-biphosphateFructose 1,6-bisphosphateME268233----
Gamma-Aminobutyric acidgamma-Aminobutyric acidME268234----
GlutamineGlutamineME268236----
Glycerol 3-phosphatesn-Glycero-3-phosphateME268237----
GlycineGlycineME268239----
GSHGlutathioneME268240----
GSSGOxidized glutathioneME268241----
Guanidoacetic acidGuanidoacetic acidME268242----
HistidineHistidineME268243----
HypotaurineHypotaurineME268244----
HypoxanthineHypoxanthineME268245----
IMPIMPME268246----
Indolelactic acidIndolelactic acidME268247----
InosineInosineME268248----
IsoleucineIsoleucineME268249----
KynurenineKynurenineME268250----
LeucineLeucineME268251----
LysineLysineME268252----
MethionineMethionineME268253----
Methionine sulfoxideMethionine sulfoxideME268254----
N6-acetyllysineN6-AcetyllysineME268255----
N-acetylglutamic acidN-Acetylglutamic acidME268211----
NiacinamideNiacinamideME268256----
OrnithineOrnithineME268257----
Pantothenic acidPantothenic acidME268258----
PhenylalaninePhenylalanineME268260----
PhosphocreatinePhosphocreatineME268262----
PhosphoserinePhosphoserineME268263----
Picolinic acidPicolinic acidME268264----
Pipecolic acidPipecolic acidME268265----
ProlineProlineME268266----
RiboflavinRiboflavinME268267----
S-AdenosylhomocysteineS-AdenosylhomocysteineME268268----
SarcosineSarcosineME268269----
SerineSerineME268270----
sn-glycero-3-phosphocholinesn-Glycero-3-phosphocholineME268238----
ThreonineThreonineME268271----
TryptophanTryptophanME268273----
TyrosineTyrosineME268274----
UMPUMPME268275----
Urocanic acidUrocanic acidME268272----
ValineValineME268276----


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
2-hydroxybutyric acid2-Hydroxybutyric acidME268277----
2-hydroxyglutaric acid2-Hydroxyglutaric acidME268278----
3-hydroxyisobutyric acid3-Hydroxyisobutyric acidME268280----
3-Methyl-2-oxovaleric acid3-Methyl-2-oxovaleric acidME268282----
3-methyl pyruvic acid3-Methyl pyruvic acidME268284----
3-Phosphoglyceric acid3-Phosphoglyceric acidME268283----
5'-Methylthioadenosine5'-MethylthioadenosineME268307----
AllantoinAllantoinME268286----
AMPAMPME268287----
Argininosuccinic acidArgininosuccinic acidME268288----
Aspartic acidAspartic acidME268290----
beta-hydroxybutyric acid3-Hydroxybutyric acidME268279----
Cis-Aconitic acidcis-Aconitic acidME268291----
Citric acidCitric acidME268292----
CTPCTPME268293----
Cysteic acidCysteic acidME268294----
Dihydroxyacetone phosphateDihydroxyacetone phosphateME268295----
dTMPdTMPME268296----
Fumaric acidFumaric acidME268297----
GlucoseGlucoseME268298----
glucose-1-phosphate/fructose-6 -hosphate-ME268299----
Glucose-6-phosphateGlucose 6-phosphateME268300----
Glutamic acidGlutamic acidME268301----
Glyceric acidGlyceric acidME268302----
GMPGMPME268303----
Itaconic acidItaconic acidME268304----
Ketoisovaleric acidKetoisovaleric acidME268281----
Lactic acidLactic acidME268305----
Malic acidMalic acidME268306----
N-6-trimethyllysineN-6-TrimethyllysineME268317----
Orotic acidOrotic acidME268309----
Oxoglutaric acid2-Oxoglutaric acidME268285----
P-Aminobenzoic acidp-Aminobenzoic acidME268310----
PhosphoethanolaminePhosphoethanolamineME268308----
Pyruvic acidPyruvic acidME268311----
Ribose-5-phosphateRibose 5-phosphateME268312----
SorbitolSorbitolME268313----
Succinic acidSuccinic acidME268314----
ThiamineThiamineME268315----
ThymidineThymidineME268316----
UDP-glucoseUDP-glucoseME268319----
UDP-N-acetylglucosamineUDP-N-acetylglucosamineME268318----
UracilUracilME268320----
Vitamin CVitamin CME268289----
XanthineXanthineME268321----


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