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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
citrate-13C0Citric acidME665730311C00158--
citrate-13C1Citric acidME665649311C00158--
citrate-13C2Citric acidME665674311C00158--
citrate-13C3Citric acidME665671311C00158--
citrate-13C4Citric acidME665621311C00158--
citrate-13C5Citric acidME665582311C00158--
citrate-13C6Citric acidME665595311C00158--
Gly-13C0GlycineME665576750C00037--
Gly-13C1GlycineME665653750C00037--
Gly-13C2GlycineME665600750C00037--
Succinate-13C0Succinic acidME6657081110C00042--
Succinate-13C1Succinic acidME6655661110C00042--
Succinate-13C2Succinic acidME6655741110C00042--
Succinate-13C3Succinic acidME6656431110C00042--
Succinate-13C4Succinic acidME6655581110C00042--
Succinate-ALLSuccinic acidME6656241110C00042--
Ala-13C0AlanineME6656135950C00041--
Ala-13C1AlanineME6657375950C00041--
Ala-13C2AlanineME6655755950C00041--
Ala-13C3AlanineME6655385950C00041--
Ser-13C0SerineME6656025951C00065--
Ser-13C1SerineME6655725951C00065--
Ser-13C2SerineME6655095951C00065--
Ser-13C3SerineME6655555951C00065--
Asp-13C0Aspartic acidME6656285960C00049--
Asp-13C1Aspartic acidME6655965960C00049--
Asp-13C2Aspartic acidME6656775960C00049--
Asp-13C3Aspartic acidME6657255960C00049--
Asp-13C4Aspartic acidME6657195960C00049--
Gln-13C0GlutamineME6656595961C00064--
Gln-13C1GlutamineME6655655961C00064--
Gln-13C2GlutamineME6655525961C00064--
Gln-13C3GlutamineME6656885961C00064--
Gln-13C4GlutamineME6657215961C00064--
Gln-13C5GlutamineME6656805961C00064--
Tyr-13C0TyrosineME6656996057C00082--
Tyr-13C1TyrosineME6655976057C00082--
Tyr-13C2TyrosineME6655736057C00082--
Tyr-13C3TyrosineME6656906057C00082--
Tyr-13C4TyrosineME6656606057C00082--
Tyr-13C5TyrosineME6656736057C00082--
Tyr-13C6TyrosineME6656916057C00082--
Tyr-13C7TyrosineME6655676057C00082--
Tyr-13C8TyrosineME6655446057C00082--
Tyr-13C9TyrosineME6655836057C00082--
Leu-13C0LeucineME6656656106C00123--
Leu-13C1LeucineME6656056106C00123--
Leu-13C2LeucineME6656116106C00123--
Leu-13C3LeucineME6656986106C00123--
Leu-13C4LeucineME6655876106C00123--
Leu-13C5LeucineME6656666106C00123--
Leu-13C6LeucineME6655936106C00123--
Met-13C0MethionineME6655316137C00073--
Met-13C1MethionineME6657146137C00073--
Met-13C2MethionineME6656156137C00073--
Met-13C3MethionineME6656406137C00073--
Met-13C4MethionineME6656816137C00073--
Met-13C5MethionineME6655486137C00073--
Phe-13C0PhenylalanineME6656146140C00079--
Phe-13C1PhenylalanineME6657126140C00079--
Phe-13C2PhenylalanineME6656756140C00079--
Phe-13C3PhenylalanineME6656106140C00079--
Phe-13C4PhenylalanineME6656386140C00079--
Phe-13C5PhenylalanineME6655056140C00079--
Phe-13C6PhenylalanineME6656866140C00079--
Phe-13C7PhenylalanineME6656186140C00079--
Phe-13C8PhenylalanineME6655776140C00079--
Phe-13C9PhenylalanineME6657286140C00079--
Asn-13C0AsparagineME6657136267C00152--
Asn-13C1AsparagineME6655436267C00152--
Asn-13C2AsparagineME6656396267C00152--
Asn-13C3AsparagineME6656446267C00152--
Asn-13C4AsparagineME6657206267C00152--
His-13C0HistidineME6655606274C00135--
His-13C1HistidineME6656066274C00135--
His-13C2HistidineME6656616274C00135--
His-13C3HistidineME6657326274C00135--
His-13C4HistidineME6655796274C00135--
His-13C5HistidineME6656706274C00135--
His-13C6HistidineME6655536274C00135--
Val-13C0ValineME6657386287C00183--
Val-13C1ValineME6657316287C00183--
Val-13C2ValineME6655866287C00183--
Val-13C3ValineME6656676287C00183--
Val-13C4ValineME6656076287C00183--
Val-13C5ValineME6655076287C00183--
Thr-13C0ThreonineME6655516288C00188--
Thr-13C1ThreonineME6657426288C00188--
Thr-13C2ThreonineME6657356288C00188--
Thr-13C3ThreonineME6655196288C00188--
Thr-13C4ThreonineME6655266288C00188--
Trp-13C0TryptophanME6655546305C00078--
Trp-13C1TryptophanME6655456305C00078--
Trp-13C10TryptophanME6655886305C00078--
Trp-13C11TryptophanME6657046305C00078--
Trp-13C2TryptophanME6657276305C00078--
Trp-13C3TryptophanME6656046305C00078--
Trp-13C4TryptophanME6655986305C00078--
Trp-13C5TryptophanME6655706305C00078--
Trp-13C6TryptophanME6655476305C00078--
Trp-13C7TryptophanME6656586305C00078--
Trp-13C8TryptophanME6656726305C00078--
Trp-13C9TryptophanME6655166305C00078--
Ile-13C0IsoleucineME6655996306C00407--
Ile-13C1IsoleucineME6657226306C00407--
Ile-13C2IsoleucineME6657056306C00407--
Ile-13C3IsoleucineME6656686306C00407--
Ile-13C4IsoleucineME6655286306C00407--
Ile-13C5IsoleucineME6656826306C00407--
Ile-13C6IsoleucineME6655406306C00407--
Arg-13C0ArginineME6656976322C00062--
Arg-13C1ArginineME6657106322C00062--
Arg-13C2ArginineME6656836322C00062--
Arg-13C3ArginineME6657096322C00062--
Arg-13C4ArginineME6656336322C00062--
Arg-13C5ArginineME6655136322C00062--
Arg-13C6ArginineME6655326322C00062--
Glu-13C0Glutamic acidME66566233032---
Glu-13C1Glutamic acidME66571633032---
Glu-13C2Glutamic acidME66570333032---
Glu-13C3Glutamic acidME66568933032---
Glu-13C4Glutamic acidME66561933032---
Glu-13C5Glutamic acidME66552233032---
lactate-13C0Lactic acidME665546107689C00186--
lactate-13C1Lactic acidME665741107689C00186--
lactate-13C2Lactic acidME665729107689C00186--
lactate-13C3Lactic acidME665616107689C00186--
Cys-13C0CysteineME665556115015C05824--
Cys-13C1CysteineME665647115015C05824--
Cys-13C2CysteineME665609115015C05824--
Cys-13C3CysteineME665718115015C05824--
Pro-13C0ProlineME665591145742C00148--
Pro-13C1ProlineME665715145742C00148--
Pro-13C2ProlineME665648145742C00148--
Pro-13C3ProlineME665642145742C00148--
Pro-13C4ProlineME665724145742C00148--
Pro-13C5ProlineME665654145742C00148--
Malate-13C0Malic acidME665669222656C00149--
Malate-13C1Malic acidME665646222656C00149--
Malate-13C2Malic acidME665584222656C00149--
Malate-13C3Malic acidME665726222656C00149--
Malate-13C4Malic acidME665601222656C00149--
fumarate-13C0Fumaric acidME665594444972C00122--
fumarate-13C1Fumaric acidME665590444972C00122--
fumarate-13C2Fumaric acidME665629444972C00122--
fumarate-13C3Fumaric acidME665535444972C00122--
fumarate-13C4Fumaric acidME665515444972C00122--
Lys-13C0LysineME6655084153392---
Lys-13C1LysineME6655784153392---
Lys-13C2LysineME6655714153392---
Lys-13C3LysineME6655634153392---
Lys-13C4LysineME6655494153392---
Lys-13C5LysineME6656364153392---
Lys-13C6LysineME6657334153392---
ascorbate-13C0Vitamin CME66551854670067C00072--
ascorbate-13C1Vitamin CME66561754670067C00072--
ascorbate-13C2Vitamin CME66551154670067C00072--
ascorbate-13C3Vitamin CME66552054670067C00072--
ascorbate-13C4Vitamin CME66554254670067C00072--
ascorbate-13C5Vitamin CME66556154670067C00072--
ascorbate-13C6Vitamin CME66566354670067C00072--
a-glycerol-3P_1-13C0sn-Glycero-3-phosphateME665514-C00093--
a-glycerol-3P_1-13C1sn-Glycero-3-phosphateME665701-C00093--
a-glycerol-3P_1-13C2sn-Glycero-3-phosphateME665626-C00093--
a-glycerol-3P_1-13C3sn-Glycero-3-phosphateME665743-C00093--
a-glycerol-3P_1-ALLsn-Glycero-3-phosphateME665512-C00093--
a-glycerol-3P_2-13C0sn-Glycero-3-phosphateME665630-C00093--
a-glycerol-3P_2-13C1sn-Glycero-3-phosphateME665736-C00093--
a-glycerol-3P_2-13C2sn-Glycero-3-phosphateME665622-C00093--
a-glycerol-3P_2-13C3sn-Glycero-3-phosphateME665707-C00093--
a-glycerol-3P_2-ALLsn-Glycero-3-phosphateME665634-C00093--
a-ketoglutarate-13C02-Oxoglutaric acidME665569-C00026--
a-ketoglutarate-13C12-Oxoglutaric acidME665685-C00026--
a-ketoglutarate-13C22-Oxoglutaric acidME665521-C00026--
a-ketoglutarate-13C32-Oxoglutaric acidME665534-C00026--
a-ketoglutarate-13C42-Oxoglutaric acidME665723-C00026--
a-ketoglutarate-13C52-Oxoglutaric acidME665580-C00026--
a-ketoglutarate-ALL2-Oxoglutaric acidME665527-C00026--
Ala-ALLAlanineME665656-C00041--
Arg-ALLArginineME665679----
ascorbate-ALLVitamin CME665533----
Asn-ALLAsparagineME665510----
Asp-ALLAspartic acidME665635----
bOHbutyrate-13C0-ME665536----
bOHbutyrate-13C1-ME665645----
bOHbutyrate-13C2-ME665539----
bOHbutyrate-13C3-ME665687----
bOHbutyrate-13C4-ME665537----
bOHbutyrate-ALL-ME665657----
c-aconitate-13C0-ME665684----
c-aconitate-13C1-ME665740----
c-aconitate-13C2-ME665694----
c-aconitate-13C3-ME665625----
c-aconitate-13C4-ME665702----
c-aconitate-13C5-ME665517----
c-aconitate-13C6-ME665568----
c-aconitate-ALL-ME665632----
citrate-ALLCitric acidME665603----
Cys-ALLCysteineME665652----
fumarate-ALLFumaric acidME665739----
GAB-13C0-ME665581----
GAB-13C1-ME665637----
GAB-13C2-ME665530----
GAB-13C3-ME665678----
GAB-13C4-ME665523----
GAB-ALL-ME665651----
Gln-ALLGlutamineME665623----
Glu-ALLGlutamic acidME665627----
Gly-ALLGlycineME665559----
His-ALLHistidineME665589----
Ile-ALLIsoleucineME665525----
lactate-ALLLactic acidME665695----
Leu-ALLLeucineME665693----
Lys-ALLLysineME665700----
Malate-ALLMalic acidME665529----
Met-ALLMethionineME665620----
Norleu-ALL-ME665541----
OHPro-13C0-ME665631----
OHPro-13C1-ME665564----
OHPro-13C2-ME665557----
OHPro-13C3-ME665641----
OHPro-13C4-ME665655----
OHPro-13C5-ME665608----
OHPro-ALL-ME665734----
Orn-13C0OrnithineME665692----
Orn-13C1OrnithineME665592----
Orn-13C2OrnithineME665650----
Orn-13C3OrnithineME665706----
Orn-13C4OrnithineME665696----
Orn-13C5OrnithineME665524----
Orn-ALLOrnithineME665504----
Phe-ALLPhenylalanineME665717----
PO4-ALL-ME665562----
Pro-ALLProlineME665585----
SeMet_NF-ALL-ME665664----
Ser-ALLSerineME665550----
Thr-ALLThreonineME665612----
Trp-ALLTryptophanME665711----
Tyr-ALLTyrosineME665676----
Val-ALLValineME665506----


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