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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
2-deoxyribose-5P-ME736672----
3-Aminoisobutanoic acid (2-methyl-beta-alanine)-ME736588----
3-Phosphoglyceric acid3-Phosphoglyceric acidME736589----
3-UreidopropionateUreidopropionic acidME736673----
6-Phosphono-gluconic acid-ME736590----
AcetylcarnitineCAR 2:0ME736591----
Acetyl-CoAAcetyl-CoAME736592----
Aconitic acidcis-Aconitic acidME736593----
AdenosineAdenosineME736594----
Adenosine diphosphate (ADP)-ME736595----
Adenosine monophosphate (AMP)AMPME736596----
Adenosine triphosphate (ATP)-ME736597----
AlanineAlanineME736598----
alpha-Ketoglutaric acid2-Oxoglutaric acidME736599----
ArginineArginineME736670----
AsparagineAsparagineME736600----
Aspartic acidAspartic acidME736601----
Beta-Alaninebeta-AlanineME736602----
Citric acid + Isocitric acid-ME736603----
CitrullineCitrullineME736604----
CMPCMPME736605----
CreatineCreatineME736675----
CysteineCysteineME736676----
cystineCystineME736606----
Cytidine 5'-triphosphateCTPME736607----
CytosineCytosineME736608----
d-ADPdADPME736609----
d-AMPdAMPME736610----
d-ATPdATPME736611----
d-CDPdCDPME736677----
d-CMPdCMPME736612----
Deoxyguanosine diphosphatedGDPME736613----
d-GMPdGMPME736614----
d-GTPdGTPME736615----
DihydrouracilDihydrouracilME736616----
Erythrose 4-PErythrose 4-phosphateME736678----
Farnesyl -PP-ME736679----
"Fructose1,6-bisphosphate"Fructose 1,6-bisphosphateME736617----
Fumaric acidFumaric acidME736618----
Glucosamine-6-phosphateGlucosamine 6-phosphateME736619----
glucoseGlucoseME736669----
Glucuronic acidGlucuronic acidME736680----
Glutamic acidGlutamic acidME736620----
GlutamineGlutamineME736671----
Glutathione oxidizedGlutathioneME736622----
Glutathione (reduced)GlutathioneME736621----
Glyceraldehyde 3-phosphate + DHAP-ME736623----
glycerolGlycerolME736624----
GlycineGlycineME736625----
Glyoxylic acidGlyoxylic acidME736681----
GMPGMPME736626----
GuanosineGuanosineME736627----
Guanosine triphosphate (GTP)-ME736628----
Hexose-phosphateHexose 6-phosphateME736629----
HistidineHistidineME736630----
IMPIMPME736631----
InositolInositolME736632----
IsoleucineIsoleucineME736633----
Itaconic AcidItaconic acidME736634----
Lactic AcidLactic acidME736635----
LeucineLeucineME736674----
LysineLysineME736636----
Malic acidMalic acidME736637----
MethionineMethionineME736638----
Mevalonic acidMevalonic acidME736639----
Mevalonic acid 5-P5-Phosphomevalonic acidME736682----
N-Acetyl-glucosamine 1-phosphateN-Acetylglucosamine 1-phosphateME736640----
N-Acetylneuraminic acidN-Acetylneuraminic acidME736641----
NAD+NADME736642----
NADHNADHME736683----
NADP+NADPME736643----
NADPHNADPHME736684----
Niacin (NA)-ME736644----
NMNNicotinamide ribotideME736685----
OrnithineOrnithineME736645----
OxaloacetateOxaloacetic acidME736686----
pantothenic acidPantothenic acidME736646----
"Pentose - Phosphate (ribose, ribulose and xylulos...-ME736647----
PhenylalaninePhenylalanineME736648----
PhenylpyruvatePhenylpyruvic acidME736687----
PhosphocreatinePhosphocreatineME736649----
Phosphoenolpyruvic acidPhosphoenolpyruvic acidME736650----
ProlineProlineME736651----
Pyruvic acidPyruvic acidME736652----
Sedoheptulose 7-P-ME736688----
SerineSerineME736653----
Succinic acidSuccinic acidME736654----
SuccinylCoASuccinyl-CoAME736689----
ThreonineThreonineME736655----
ThymidineThymidineME736690----
Thymidine triphosphate-ME736656----
ThymineThymineME736657----
TMPTMPME736691----
TryptophanTryptophanME736658----
TyrosineTyrosineME736659----
UDP-GlcNAcUDP-N-acetylglucosamineME736660----
UracilUracilME736661----
UridineUridineME736662----
Uridine 5'-diphosphate (UDP)UDPME736663----
Uridine 5'-triphosphateUTPME736664----
Uridine diphosphate glucoseUDP-glucoseME736665----
Uridine monophosphateUMPME736666----
ValineValineME736667----
XanthineXanthineME736668----


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-deoxyribose-5P-ME736776----
3-Aminoisobutanoic acid (2-methyl-beta-alanine)-ME736692----
3-Phosphoglyceric acid3-Phosphoglyceric acidME736693----
3-UreidopropionateUreidopropionic acidME736777----
6-Phosphono-gluconic acid-ME736694----
AcetylcarnitineCAR 2:0ME736695----
Acetyl-CoAAcetyl-CoAME736696----
Aconitic acidcis-Aconitic acidME736697----
AdenosineAdenosineME736698----
Adenosine diphosphate (ADP)-ME736699----
Adenosine monophosphate (AMP)AMPME736700----
Adenosine triphosphate (ATP)-ME736701----
AlanineAlanineME736702----
alpha-Ketoglutaric acid2-Oxoglutaric acidME736703----
ArginineArginineME736774----
AsparagineAsparagineME736704----
Aspartic acidAspartic acidME736705----
Beta-Alaninebeta-AlanineME736706----
Citric acid + Isocitric acid-ME736707----
CitrullineCitrullineME736708----
CMPCMPME736709----
CreatineCreatineME736779----
CysteineCysteineME736780----
cystineCystineME736710----
Cytidine 5'-triphosphateCTPME736711----
CytosineCytosineME736712----
d-ADPdADPME736713----
d-AMPdAMPME736714----
d-ATPdATPME736715----
d-CDPdCDPME736781----
d-CMPdCMPME736716----
Deoxyguanosine diphosphatedGDPME736717----
d-GMPdGMPME736718----
d-GTPdGTPME736719----
DihydrouracilDihydrouracilME736720----
Erythrose 4-PErythrose 4-phosphateME736782----
Farnesyl -PP-ME736783----
"Fructose1,6-bisphosphate"Fructose 1,6-bisphosphateME736721----
Fumaric acidFumaric acidME736722----
Glucosamine-6-phosphateGlucosamine 6-phosphateME736723----
glucoseGlucoseME736773----
Glucuronic acidGlucuronic acidME736784----
Glutamic acidGlutamic acidME736724----
GlutamineGlutamineME736775----
Glutathione oxidizedGlutathioneME736726----
Glutathione (reduced)GlutathioneME736725----
Glyceraldehyde 3-phosphate + DHAP-ME736727----
glycerolGlycerolME736728----
GlycineGlycineME736729----
Glyoxylic acidGlyoxylic acidME736785----
GMPGMPME736730----
GuanosineGuanosineME736731----
Guanosine triphosphate (GTP)-ME736732----
Hexose-phosphateHexose 6-phosphateME736733----
HistidineHistidineME736734----
IMPIMPME736735----
InositolInositolME736736----
IsoleucineIsoleucineME736737----
Itaconic AcidItaconic acidME736738----
Lactic AcidLactic acidME736739----
LeucineLeucineME736778----
LysineLysineME736740----
Malic acidMalic acidME736741----
MethionineMethionineME736742----
Mevalonic acidMevalonic acidME736743----
Mevalonic acid 5-P5-Phosphomevalonic acidME736786----
N-Acetyl-glucosamine 1-phosphateN-Acetylglucosamine 1-phosphateME736744----
N-Acetylneuraminic acidN-Acetylneuraminic acidME736745----
NAD+NADME736746----
NADHNADHME736787----
NADP+NADPME736747----
NADPHNADPHME736788----
Niacin (NA)-ME736748----
NMNNicotinamide ribotideME736789----
OrnithineOrnithineME736749----
OxaloacetateOxaloacetic acidME736790----
pantothenic acidPantothenic acidME736750----
"Pentose - Phosphate (ribose, ribulose and xylulos...-ME736751----
PhenylalaninePhenylalanineME736752----
PhenylpyruvatePhenylpyruvic acidME736791----
PhosphocreatinePhosphocreatineME736753----
Phosphoenolpyruvic acidPhosphoenolpyruvic acidME736754----
ProlineProlineME736755----
Pyruvic acidPyruvic acidME736756----
Sedoheptulose 7-P-ME736792----
SerineSerineME736757----
Succinic acidSuccinic acidME736758----
SuccinylCoASuccinyl-CoAME736793----
ThreonineThreonineME736759----
ThymidineThymidineME736794----
Thymidine triphosphate-ME736760----
ThymineThymineME736761----
TMPTMPME736795----
TryptophanTryptophanME736762----
TyrosineTyrosineME736763----
UDP-GlcNAcUDP-N-acetylglucosamineME736764----
UracilUracilME736765----
UridineUridineME736766----
Uridine 5'-diphosphate (UDP)UDPME736767----
Uridine 5'-triphosphateUTPME736768----
Uridine diphosphate glucoseUDP-glucoseME736769----
Uridine monophosphateUMPME736770----
ValineValineME736771----
XanthineXanthineME736772----


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