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Analysis: GCMS positive ion mode

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
a-glycerol-3P_1-13C0sn-Glycero-3-phosphateME066765-C00093--
a-glycerol-3P_1-13C1sn-Glycero-3-phosphateME066952-C00093--
a-glycerol-3P_1-13C2sn-Glycero-3-phosphateME066877-C00093--
a-glycerol-3P_1-13C3sn-Glycero-3-phosphateME066994-C00093--
a-glycerol-3P_1-ALLsn-Glycero-3-phosphateME066763-C00093--
a-glycerol-3P_2-13C0sn-Glycero-3-phosphateME066881-C00093--
a-glycerol-3P_2-13C1sn-Glycero-3-phosphateME066987-C00093--
a-glycerol-3P_2-13C2sn-Glycero-3-phosphateME066873-C00093--
a-glycerol-3P_2-13C3sn-Glycero-3-phosphateME066958-C00093--
a-glycerol-3P_2-ALLsn-Glycero-3-phosphateME066885-C00093--
a-ketoglutarate-13C0Oxoglutaric acidME066820-C00026--
a-ketoglutarate-13C1Oxoglutaric acidME066936-C00026--
a-ketoglutarate-13C2Oxoglutaric acidME066772-C00026--
a-ketoglutarate-13C3Oxoglutaric acidME066785-C00026--
a-ketoglutarate-13C4Oxoglutaric acidME066974-C00026--
a-ketoglutarate-13C5Oxoglutaric acidME066831-C00026--
a-ketoglutarate-ALLOxoglutaric acidME066778-C00026--
Ala-13C0AlanineME0668645950C00041--
Ala-13C1AlanineME0669885950C00041--
Ala-13C2AlanineME0668265950C00041--
Ala-13C3AlanineME0667895950C00041--
Ala-ALLAlanineME066907-C00041--
Arg-13C0ArginineME0669486322C00062--
Arg-13C1ArginineME0669616322C00062--
Arg-13C2ArginineME0669346322C00062--
Arg-13C3ArginineME0669606322C00062--
Arg-13C4ArginineME0668846322C00062--
Arg-13C5ArginineME0667646322C00062--
Arg-13C6ArginineME0667836322C00062--
Arg-ALLArginineME066930----
ascorbate-13C0Vitamin CME06676954670067C00072--
ascorbate-13C1Vitamin CME06686854670067C00072--
ascorbate-13C2Vitamin CME06676254670067C00072--
ascorbate-13C3Vitamin CME06677154670067C00072--
ascorbate-13C4Vitamin CME06679354670067C00072--
ascorbate-13C5Vitamin CME06681254670067C00072--
ascorbate-13C6Vitamin CME06691454670067C00072--
ascorbate-ALLVitamin CME066784----
Asn-13C0AsparagineME0669646267C00152--
Asn-13C1AsparagineME0667946267C00152--
Asn-13C2AsparagineME0668906267C00152--
Asn-13C3AsparagineME0668956267C00152--
Asn-13C4AsparagineME0669716267C00152--
Asn-ALLAsparagineME066761----
Asp-13C0Aspartic acidME0668795960C00049--
Asp-13C1Aspartic acidME0668475960C00049--
Asp-13C2Aspartic acidME0669285960C00049--
Asp-13C3Aspartic acidME0669765960C00049--
Asp-13C4Aspartic acidME0669705960C00049--
Asp-ALLAspartic acidME066886----
bOHbutyrate-13C0-ME066787----
bOHbutyrate-13C1-ME066896----
bOHbutyrate-13C2-ME066790----
bOHbutyrate-13C3-ME066938----
bOHbutyrate-13C4-ME066788----
bOHbutyrate-ALL-ME066908----
c-aconitate-13C0-ME066935----
c-aconitate-13C1-ME066991----
c-aconitate-13C2-ME066945----
c-aconitate-13C3-ME066876----
c-aconitate-13C4-ME066953----
c-aconitate-13C5-ME066768----
c-aconitate-13C6-ME066819----
c-aconitate-ALL-ME066883----
citrate-13C0Citric acidME066981311C00158--
citrate-13C1Citric acidME066900311C00158--
citrate-13C2Citric acidME066925311C00158--
citrate-13C3Citric acidME066922311C00158--
citrate-13C4Citric acidME066872311C00158--
citrate-13C5Citric acidME066833311C00158--
citrate-13C6Citric acidME066846311C00158--
citrate-ALLCitric acidME066854----
Cys-13C0CysteineME066807115015C05824--
Cys-13C1CysteineME066898115015C05824--
Cys-13C2CysteineME066860115015C05824--
Cys-13C3CysteineME066969115015C05824--
Cys-ALLCysteineME066903----
fumarate-13C0Fumaric acidME066845444972C00122--
fumarate-13C1Fumaric acidME066841444972C00122--
fumarate-13C2Fumaric acidME066880444972C00122--
fumarate-13C3Fumaric acidME066786444972C00122--
fumarate-13C4Fumaric acidME066766444972C00122--
fumarate-ALLFumaric acidME066990----
GAB-13C0-ME066832----
GAB-13C1-ME066888----
GAB-13C2-ME066781----
GAB-13C3-ME066929----
GAB-13C4-ME066774----
GAB-ALL-ME066902----
Gln-13C0GlutamineME0669105961C00064--
Gln-13C1GlutamineME0668165961C00064--
Gln-13C2GlutamineME0668035961C00064--
Gln-13C3GlutamineME0669395961C00064--
Gln-13C4GlutamineME0669725961C00064--
Gln-13C5GlutamineME0669315961C00064--
Gln-ALLGlutamineME066874----
Glu-13C0Glutamic acidME06691333032---
Glu-13C1Glutamic acidME06696733032---
Glu-13C2Glutamic acidME06695433032---
Glu-13C3Glutamic acidME06694033032---
Glu-13C4Glutamic acidME06687033032---
Glu-13C5Glutamic acidME06677333032---
Glu-ALLGlutamic acidME066878----
Gly-13C0GlycineME066827750C00037--
Gly-13C1GlycineME066904750C00037--
Gly-13C2GlycineME066851750C00037--
Gly-ALLGlycineME066810----
His-13C0HistidineME0668116274C00135--
His-13C1HistidineME0668576274C00135--
His-13C2HistidineME0669126274C00135--
His-13C3HistidineME0669836274C00135--
His-13C4HistidineME0668306274C00135--
His-13C5HistidineME0669216274C00135--
His-13C6HistidineME0668046274C00135--
His-ALLHistidineME066840----
Ile-13C0IsoleucineME0668506306C00407--
Ile-13C1IsoleucineME0669736306C00407--
Ile-13C2IsoleucineME0669566306C00407--
Ile-13C3IsoleucineME0669196306C00407--
Ile-13C4IsoleucineME0667796306C00407--
Ile-13C5IsoleucineME0669336306C00407--
Ile-13C6IsoleucineME0667916306C00407--
Ile-ALLIsoleucineME066776----
lactate-13C0Lactic acidME066797107689C00186--
lactate-13C1Lactic acidME066992107689C00186--
lactate-13C2Lactic acidME066980107689C00186--
lactate-13C3Lactic acidME066867107689C00186--
lactate-ALLLactic acidME066946----
Leu-13C0LeucineME0669166106C00123--
Leu-13C1LeucineME0668566106C00123--
Leu-13C2LeucineME0668626106C00123--
Leu-13C3LeucineME0669496106C00123--
Leu-13C4LeucineME0668386106C00123--
Leu-13C5LeucineME0669176106C00123--
Leu-13C6LeucineME0668446106C00123--
Leu-ALLLeucineME066944----
Lys-13C0LysineME0667594153392---
Lys-13C1LysineME0668294153392---
Lys-13C2LysineME0668224153392---
Lys-13C3LysineME0668144153392---
Lys-13C4LysineME0668004153392---
Lys-13C5LysineME0668874153392---
Lys-13C6LysineME0669844153392---
Lys-ALLLysineME066951----
Malate-13C0Malic acidME066920222656C00149--
Malate-13C1Malic acidME066897222656C00149--
Malate-13C2Malic acidME066835222656C00149--
Malate-13C3Malic acidME066977222656C00149--
Malate-13C4Malic acidME066852222656C00149--
Malate-ALLMalic acidME066780----
Met-13C0MethionineME0667826137C00073--
Met-13C1MethionineME0669656137C00073--
Met-13C2MethionineME0668666137C00073--
Met-13C3MethionineME0668916137C00073--
Met-13C4MethionineME0669326137C00073--
Met-13C5MethionineME0667996137C00073--
Met-ALLMethionineME066871----
Norleu-ALL-ME066792----
OHPro-13C0-ME066882----
OHPro-13C1-ME066815----
OHPro-13C2-ME066808----
OHPro-13C3-ME066892----
OHPro-13C4-ME066906----
OHPro-13C5-ME066859----
OHPro-ALL-ME066985----
Orn-13C0OrnithineME066943----
Orn-13C1OrnithineME066843----
Orn-13C2OrnithineME066901----
Orn-13C3OrnithineME066957----
Orn-13C4OrnithineME066947----
Orn-13C5OrnithineME066775----
Orn-ALLOrnithineME066755----
Phe-13C0PhenylalanineME0668656140C00079--
Phe-13C1PhenylalanineME0669636140C00079--
Phe-13C2PhenylalanineME0669266140C00079--
Phe-13C3PhenylalanineME0668616140C00079--
Phe-13C4PhenylalanineME0668896140C00079--
Phe-13C5PhenylalanineME0667566140C00079--
Phe-13C6PhenylalanineME0669376140C00079--
Phe-13C7PhenylalanineME0668696140C00079--
Phe-13C8PhenylalanineME0668286140C00079--
Phe-13C9PhenylalanineME0669796140C00079--
Phe-ALLPhenylalanineME066968----
PO4-ALL-ME066813----
Pro-13C0ProlineME066842145742C00148--
Pro-13C1ProlineME066966145742C00148--
Pro-13C2ProlineME066899145742C00148--
Pro-13C3ProlineME066893145742C00148--
Pro-13C4ProlineME066975145742C00148--
Pro-13C5ProlineME066905145742C00148--
Pro-ALLProlineME066836----
SeMet_NF-ALL-ME066915----
Ser-13C0SerineME0668535951C00065--
Ser-13C1SerineME0668235951C00065--
Ser-13C2SerineME0667605951C00065--
Ser-13C3SerineME0668065951C00065--
Ser-ALLSerineME066801----
Succinate-13C0Succinic acidME0669591110C00042--
Succinate-13C1Succinic acidME0668171110C00042--
Succinate-13C2Succinic acidME0668251110C00042--
Succinate-13C3Succinic acidME0668941110C00042--
Succinate-13C4Succinic acidME0668091110C00042--
Succinate-ALLSuccinic acidME0668751110C00042--
Thr-13C0ThreonineME0668026288C00188--
Thr-13C1ThreonineME0669936288C00188--
Thr-13C2ThreonineME0669866288C00188--
Thr-13C3ThreonineME0667706288C00188--
Thr-13C4ThreonineME0667776288C00188--
Thr-ALLThreonineME066863----
Trp-13C0TryptophanME0668056305C00078--
Trp-13C1TryptophanME0667966305C00078--
Trp-13C10TryptophanME0668396305C00078--
Trp-13C11TryptophanME0669556305C00078--
Trp-13C2TryptophanME0669786305C00078--
Trp-13C3TryptophanME0668556305C00078--
Trp-13C4TryptophanME0668496305C00078--
Trp-13C5TryptophanME0668216305C00078--
Trp-13C6TryptophanME0667986305C00078--
Trp-13C7TryptophanME0669096305C00078--
Trp-13C8TryptophanME0669236305C00078--
Trp-13C9TryptophanME0667676305C00078--
Trp-ALLTryptophanME066962----
Tyr-13C0TyrosineME0669506057C00082--
Tyr-13C1TyrosineME0668486057C00082--
Tyr-13C2TyrosineME0668246057C00082--
Tyr-13C3TyrosineME0669416057C00082--
Tyr-13C4TyrosineME0669116057C00082--
Tyr-13C5TyrosineME0669246057C00082--
Tyr-13C6TyrosineME0669426057C00082--
Tyr-13C7TyrosineME0668186057C00082--
Tyr-13C8TyrosineME0667956057C00082--
Tyr-13C9TyrosineME0668346057C00082--
Tyr-ALLTyrosineME066927----
Val-13C0ValineME0669896287C00183--
Val-13C1ValineME0669826287C00183--
Val-13C2ValineME0668376287C00183--
Val-13C3ValineME0669186287C00183--
Val-13C4ValineME0668586287C00183--
Val-13C5ValineME0667586287C00183--
Val-ALLValineME066757----


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