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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
2,5-dihydroxypyrazine NIST2,5-DihydroxypyrazineME68120423368901-397526241
2-hydroxyglutaric acid2-Hydroxyglutaric acidME68122843C02630506306247
2-hydroxyhexanoic acid2-Hydroxyhexanoic acidME68128099824-323093159
2-isopropylmalic acid2-Isopropylmalic acidME6812795280523C02504508690275
alpha-ketoglutarate2-Oxoglutaric acidME68122651C00026507392198
3-phosphoglycerate3-Phosphoglyceric acidME681227724C00597610734227
adenineAdenineME681203190C00147646534264
adenosineAdenosineME68120260961C00212918039236
alanine-alanineAla-AlaME6812785484352C00993522546116
alanineAlanineME6812555950C00041244189116
adenosine-5-monophosphateAMPME6812016083C000201038688169
aspartic acidAspartic acidME6812255960C00049480387232
benzoic acidBenzoic acidME681200243C00180339067179
beta-alaninebeta-AlanineME681224239C00099435564248
cholesterolCholesterolME6812585997C001871076014129
citric acidCitric acidME681277311C00158620091273
cytidine-5-monophosphateCMPME6812766131C00055700635243
cysteine-glycineCys-GlyME681222439498C01419715335220
cysteineCysteineME681223594C00097500158220
cytosinCytosineME681221597C00380486724254
2'-deoxyguanosineDeoxyguanosineME681281187790C00330962182295
fructoseFructoseME6812205984C02336639442307
fructose-1,6-bisphosphateFructose 1,6-bisphosphateME681275172313C00354939046315
fructose-1-phosphateFructose 1-phosphateME681248481C01094803180387
fructose-6-phosphateFructose 6-phosphateME68125769507C05345804279315
fumaric acidFumaric acidME681274444972C00122392338245
levoglucosanGlucosanME6812422724705-569637204
glucoseGlucoseME6811885793C00221714386117
glucose-1-phosphateGlucose 1-phosphateME68127365533C00103597071217
glucose-6-phosphateGlucose 6-phosphateME6812475958C00092818275387
glutamic acidGlutamic acidME68124633032C00025529100246
glutamineGlutamineME6812195961C00064600315156
glutathioneGlutathioneME681272124886C00051761296213
glyceric acidGlyceric acidME681245439194C00258377495189
glycineGlycineME681218750C00037368707248
glycolic acidGlycolic acidME681199757C00160227636177
guanineGuanineME681254764C00242744307352
guanosineGuanosineME6812706802C00387957445324
hexose NISTHexoseME681269206C00738682268204
hexose-6-phosphateHexose 6-phosphateME681251208C02965806282387
hydroxylamineHydroxylamineME681256787C00192255241146
hypoxanthineHypoxanthineME681244790C00262619128265
inosine-5'-monophosphateIMPME6812608582C001301018687169
inosineInosineME6812436021C00294897434230
isoleucineIsoleucineME6811976306C00407359251158
lactic acidLactic acidME681196107689C01432217657191
lauric acidLauric acidME6812173893C02679547906117
lysineLysineME6812165962C00047663483156
malic acidMalic acidME681195222656C00711463180233
mannose-6-phosphate NISTMannose 6-phosphateME68126865127C00275822643387
heptadecanoic acidMargaric acidME68119810465-751309117
methionineMethionineME6812156137C00073483560176
myristic acidMyristic acidME68119411005C06424634414117
N-acetylgalactosamineN-Acetyl-D-galactosamineME68126735717C05021725570202
N-acetyl-L-ornithineN-AcetylornithineME681266439232C00437694651174
nicotinamideNiacinamideME681241936C00153469827179
nicotinic acidNicotinic acidME681265938C00253366992180
N-methylalanineN-MethylalanineME6812535288725C02721286855130
O-acetylserineO-AcetylserineME68126499478C00979414914174
oleic acidOleic acidME681249445639C00712779120339
ornithine 4tmsOrnithineME6811936262C00077619548142
orotic acidOrotic acidME681214967C00295586317254
oxoprolineOxoprolineME6812407405C01879485935156
palmitic acidPalmitic acidME681213985C00249713809313
palmitoleic acidPalmitoleic acidME681192445638C08362706508117
pelargonic acidPelargonic acidME6811918158C01601399229117
pentadecanoic acidPentadecylic acidME68125213849C16537674647117
phenylalaninePhenylalanineME6812126140C00079537804218
phosphoenolpyruvatePhosphoenolpyruvic acidME6812631005C00074518184211
phosphoethanolaminePhosphoethanolamineME6812501015C00346604335299
phosphatePhosphoric acidME6812391004C00009345365314
prolineProlineME681211145742C00148364716142
propane-1,3-diol NISTPropane-1,3-diolME68121010442C02457214380177
putrescinePutrescineME6812381045C00138588119174
pyrophosphatePyrophosphateME681237644102C00013327517110
riboseRiboseME6812095779C00121553135217
ribose-5-phosphateRibose 5-phosphateME681262439167C00117733959315
serineSerineME6811905951C00065395020218
glycerol-alpha-phosphatesn-Glycero-3-phosphateME681271754C03189593299357
spermidineSpermidineME6812361102C00315792924144
stearic acidStearic acidME6811875281C01530329250100
succinic acidSuccinic acidME6812081110C00042370608247
threonineThreonineME6812076288C00188409568218
thymidineThymidineME6812065789C00214349402170
thymineThymineME6812341135C00178420133255
thymidine-5-phosphateTMPME68123512803287C00364608111170
tryptophanTryptophanME6812056305C00078780482202
tyrosineTyrosineME6811896057C00082671252218
UDP-glucuronic acidUDP-glucuronic acidME68123317473C00167587601217
UDP-N-acetylglucosamineUDP-N-acetylglucosamineME681232445675C00043625003226
uridine-5'-monophosphateUMPME6812616030C00105980179169
uracilUracilME6812311174C00106385735241
ureaUreaME6812591176C00086332913189
valineValineME6812306287C00183313502144
xylulose NISTXyluloseME6812295289590C00312553450173


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