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Analysis: GC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
phosphatePhosphoric acidME1360961004C00009348274314
pyrophosphatePyrophosphateME1360881023C00013327517110
pyridoxal-5-phosphatePyridoxal 5'-phosphateME1360891051C00018825754219
adenosine-5-monophosphateAMPME1362136083C000201041375315
pyruvic acidPyruvic acidME1360871060C00022211668174
glutamic acidGlutamic acidME13616833032C00025489240174
alpha-ketoglutarate2-Oxoglutaric acidME13620951C00026507392198
glycineGlycineME136161750C00037368707248
alanineAlanineME1362115950C00041243971116
UDP GlcNAcUDP-N-acetylglucosamineME136064445675C00043627437226
lysineLysineME1361305962C00047663483156
aspartic acidAspartic acidME1362045960C00049433075160
glutathioneGlutathioneME136165124886C00051761296213
glutamineGlutamineME1361675961C00064600315156
serineSerineME1360815951C00065395020218
methionineMethionineME1361236137C00073483560176
ornithineOrnithineME1361086262C00077527113142
tryptophanTryptophanME1360676305C00078780482202
phenylalaninePhenylalanineME1360976140C00079537804218
tyrosineTyrosineME1360666057C00082671252218
ureaUreaME1360621176C00086338716189
sucroseSucroseME1360765988C00089912704271
cysteineCysteineME1361925862C00097500158220
beta-alaninebeta-AlanineME136201239C00099435564248
glucose-1-phosphateGlucose 1-phosphateME13617065533C00103597071217
uracilUracilME1360631174C00106385735241
ribose-5-phosphateRibose 5-phosphateME136084439167C00117731096315
riboseRiboseME1360855779C00121553135217
fumaric acidFumaric acidME136174444972C00122390016245
leucineLeucineME1361336106C00123345168158
inosine-5-monophosphateIMPME1361438582C001301018687169
histidineHistidineME1361506274C00135663790154
myo-inositolMyo-inositolME136120892C00137730022305
putrescinePutrescineME1360901049C00138588119174
adenineAdenineME136215190C00147646534264
prolineProlineME136091145742C00148364716142
asparagineAsparagineME1362056267C00152553078188
nicotinamideNiacinamideME136113936C00153471602179
citric acidCitric acidME136194311C00158617342273
glycolic acidGlycolic acidME136159757C00160227636177
UDP-glucuronic acidUDP-glucuronic acidME13606517473C00167587601217
5-deoxy-5-methylthioadenosine5'-MethylthioadenosineME136218439176C00170967036236
thymineThymineME1360711135C00178420133255
benzoic acidBenzoic acidME136202243C00180339214179
valineValineME1360606287C00183313502144
dihydroxyacetoneDihydroxyacetoneME136184670C0018433212089
cholesterolCholesterolME1361965997C001871078536129
threonineThreonineME1360726288C00188409568218
ethanolamineEthanolamineME136179700C00189343800174
hydroxylamineHydroxylamineME136147787C00192253158146
ribulose-5-phosphateRibulose 5-phosphateME136083439184C00199735908357
oxalic acidOxalic acidME136106971C00209260513190
adenosineAdenosineME13621460961C00212918039236
glucoseGlucoseME13617164689C00221659798319
guanineGuanineME136157764C00242744307352
lactoseLactoseME136136440995C00243935640191
taurineTaurineME1360751123C00245556690326
palmitic acidPalmitic acidME136103985C00249713809313
glyceric acidGlyceric acidME136164439194C00258377495189
hypoxanthineHypoxanthineME136146790C00262619128265
homoserineHomoserineME13614912647C00263443878218
mannose-6-phosphate NISTMannose 6-phosphateME13612565127C00275822643387
inosineInosineME1361446021C00294897184230
orotic acidOrotic acidME136107967C00295586317254
xylulose NISTXyluloseME136054439205C00312553450173
spermidineSpermidineME1360791102C00315792924144
phosphoethanolaminePhosphoethanolamineME1360941015C00346603912299
tocopherol alpha-alpha-TocopherolME136070638015C003761067809237
xylitolXylitolME1360576912C00379567437217
xanthineXanthineME1360591188C00385701688353
guanosineGuanosineME1361566802C00387954962324
hexitolSorbitolME136154453C00392704741217
mannitolMannitolME1361266251C00392663215319
isoleucineIsoleucineME1361406306C00407359251158
aconitic acidcis-Aconitic acidME136216643757C00417586815229
5-aminovaleric acid5-Aminopentanoic acidME136219138C00431536657174
saccharopineSaccharopineME136082160556C00449865907156
ribitolRibitolME136086827C00474575497217
glutaric acidGlutaric acidME136166743C00489421260261
erythritolErythritolME136181222285C00503471922217
hydroquinoneHydroquinoneME136148785C00530422583239
lyxitolL-ArabitolME136129439255C00532573587217
glycocyamineGuanidoacetic acidME136160763C00581510732171
3-phosphoglycerate3-Phosphoglyceric acidME136220724C00597610734227
N-acetylglutamateN-Acetylglutamic acidME13611570914C00624604748216
isothreonic acidD-Threonic acidME136139151152C00639489385292
N-acetylmannosamineN-Acetyl-mannosamineME136114439281C00645735323319
malic acidMalic acidME136127525C00711463180233
oleic acidOleic acidME136110445639C00712779120339
hexoseHexoseME136153206C00738642640319
creatinineCreatinineME136193588C00791502599115
sorbitolSorbitolME1360805780C00794667922217
1-hexadecanolCetyl alcoholME1362312682C00823679596299
aminomalonateAminomalonic acidME136208100714C00872455754218
O-phosphoserineDL-O-PhosphoserineME13610957689797C01005624355356
N-acetylaspartic acidN-Acetylaspartic acidME13611865065C01042548028158
fructose-1-phosphateFructose 1-phosphateME136177439394C01094803180387
glucose-6-phosphateGlucose 6-phosphateME136169439427C01172810287387
galactinolGalactinolME13617311727586C012351017580204
cysteine-glycineCys-GlyME136191439498C01419715335220
cystineCystineME136190595C01420804619218
lactic acidLactic acidME136138612C01432217657191
stearic acidStearic acidME1360775281C01530787622117
capric acidCapric acidME1361982969C01571452386229
pelargonic acidPelargonic acidME1361008158C01601399229117
threonic acidThreonic acidME1360735460407C01620497572292
xanthosineXanthosineME13605864959C01762926133325
erythroseErythroseME136180439574C01796443306205
oxoprolineOxoprolineME1361057405C01879485935156
1-monopalmitinMG 16:0/0:0/0:0ME13622814900C01885901749129
arabitolArabitolME13620794154C01904570685217
indole-3-lactateIndolelactic acidME13614592904C02043764586202
glucoheptuloseGlucoheptuloseME1361725459879C02076828606217
fucoseFucoseME136175439650C02095578299160
xylonolactone NISTD-Xylono-1,5-lactoneME136056439692C02266535176217
dodecanolDodecanolME1361828193C02277507619243
fructoseFructoseME136178439709C02336641863307
2-hydroxyglutaric acid2-Hydroxyglutaric acidME13622643C02630506306247
lauric acidLauric acidME1361343893C02679547906117
N-methylalanineN-MethylalanineME136112-C02721285825130
hexose-6-phosphateHexose 6-phosphateME136152208C02965806282387
beta-glycerolphosphatesn-Glycero-2-phosphateME1362002526C02979574470243
methionine sulfoxideMethionine sulfoxideME136122158980C02989637588128
glycerol-alpha-phosphatesn-Glycero-3-phosphateME136162754C03189590747357
inositol-4-monophosphateInositol 4-phosphateME136142440043C03546845976315
p-hydroxylphenyllactic acid4-Hydroxyphenyllactic acidME1360939378C03672654036308
3 hydroxy-3-methylglutaric acid3-Hydroxymethylglutaric acidME1362221662C03761519310247
n-acetyl-d-hexosamineN-AcetylhexosamineME13611624139C03878746341319
fructose-6-phosphateFructose 6-phosphateME136176440641C05345804279315
glycerol-3-galactosideGalactosylglycerolME13616316048618C05401805227204
5-methoxytryptamine5-MethoxytryptamineME1362171833C05659864466174
adipic acidAdipic acidME136212196C06104474435111
terephthalic acidTerephthalic acidME1360747489C06337612262295
myristic acidMyristic acidME13611911005C06424634414285
arachidic acidArachidic acidME13620610467C06425856421117
lactuloseLactuloseME13613511333C07064929908204
maleimideMaleimideME13612810935C07272245118154
behenic acidBehenic acidME1362038215C08281920648117
lignoceric acidLignoceric acidME13613111197C08320978597132
palmitoleic acidPalmitoleic acidME136102445638C08362704511311
dehydroabietic acidDehydroabietic acidME13618794391C12078850374239
pantothenic acidPantothenic acidME1361016613C12276690887291
dihydrocholesterolDihydrocholesterolME13618566066C129781082070215
lactitolLactitolME136137157355C13542959541361
cis-gondoic acidcis-Gondoic acidME1361955282768C16526847372367
pentadecanoic acidPentadecylic acidME13609913849C16537674647117
pentitolArabitolME136098827D00061563801307
1-monostearinMG 18:0/0:0/0:0ME13622724699D01947959214203
1,2-anhydro-myo-inositol NIST1,2-Anhydro-myo-inositolME136232119054-651472318
1-methylinosine NIST1-MethylinosineME13623065095-1026110259
1-monooleinMG 18:1(9Z)/0:0/0:0ME1362295283468-952623129
2,5-dihydroxypyrazine NIST2,5-DihydroxypyrazineME13623323368901-397526241
2-hydroxypyrazinyl-2-propenoic acid ethyl ester NI...-ME136225--493127121
2-monooleinMG 0:0/18:1(9Z)/0:0ME1362245319879-941794129
2-monopalmitinMG 0:0/16:0/0:0ME136223123409-890356129
3-phenyllactic acidPhenyllactic acidME136221--516011193
alpha-aminoadipic acidalpha-Aminoadipic acidME136210--573295260
bisphosphoglycerol NIST-ME136199102018-764660299
cerotinic aciCerotic acidME13619710469-1033286145
cytidineCytidineME136189--934269223
cytidine-5-monophosphateCMPME136188--700635243
D-erythro-sphingosineSphingosineME136186--859500204
docosahexaenoic acidDocosahexaenoic acidME136183--90281991
glycyl tyrosineGly-TyrME13615892829-922071174
heptadecanoic acidMargaric acidME13615510465-751309117
hexuronic acidHexuronic acidME136151152867-667373160
isohexonic acid-ME136141604-698302333
levoglucosanGlucosanME1361322724705-569637204
methanolphosphateMethanolphosphateME13612413130-289520241
monomyristinMG 14:0ME13612179050-838305343
N-acetyl-D-galactosamineN-Acetyl-D-galactosamineME136117--723255202
octadecanolStearyl alcoholME1361118221-755409327
palatinitol1,2,3-ButanetriolME136104--996670204
phosphoenolpyruvatePhosphoenolpyruvic acidME136095--518184211
pipecolinic acidPipecolic acidME1360926931662-404121156
spermineSpermineME136078--92970286
trans-4-hydroxy-L-prolinetrans-4-HydroxyprolineME136069--459475158
trehaloseTrehaloseME136068--948197191
uridine-5-monophosphateUMPME1360616030-980179169
xyloseXyloseME136055--544100103


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