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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
3-aminoisobutyric acid3-Aminoisobutanoic acidME23389364956C05145309837102
gamma-aminobutyric acidgamma-Aminobutyric acidME233851119C00334364801102
linolenic acidOctadecatrienoic acidME2338165280934C06427780376108
creatinineCreatinineME233865588C00791502599115
alanineAlanineME2338865950C00041244189116
alanine-alanineAla-AlaME2338855484352C00993522546116
arachidic acidArachidic acidME23388010467C06425856421117
behenic acidBehenic acidME2338758215C08281920648117
heptadecanoic acidMargaric acidME23383610465-751309117
lauric acidLauric acidME2338203893C02679547840117
myristic acidMyristic acidME23380511005C06424634414117
pelargonic acidPelargonic acidME2337928158C01601399229117
stearic acidStearic acidME2337715281C01530787622117
1-monopalmitinMG 16:0/0:0/0:0ME23389714900C01885901749129
2-monooleinMG 0:0/18:1(9Z)/0:0ME2338945319879-941794129
cholesterolCholesterolME2338685997C001871076014129
oleic acidOleic acidME233798445639C00712781527129
N-methylalanineN-MethylalanineME2337995288725C02721288133130
2-hydroxybutanoic acid2-Hydroxybutyric acidME233896440864C05984258161131
ornithineOrnithineME2337976262C00077619548142
prolineProlineME233786145742C00148364716142
valineValineME2337546287C00183313502144
hydroxylamineHydroxylamineME233829787C00192255241146
linoleic acidLinoleic acidME2338175280450C01595777414150
histidineHistidineME2338316274C00135664395154
maleimideMaleimideME23381310935C07272245118154
glutamineGlutamineME2338445961C00064600315156
lysineLysineME2338155962C00047663483156
oxoprolineOxoprolineME2337957405C01879485935156
isoleucineIsoleucineME2338246306C00407359251158
leucineLeucineME2338196106C00123346357158
hexuronic acidHexuronic acidME233832152867-667373160
cytidine-5-monophosphate NISTCMPME2338626131C00055974825169
digalacturonic acidDigalacturonic acidME233860439694C02273980132169
inosine 5'-monophosphateIMPME2338268582C001301016811169
uridine-5'-monophosphateUMPME233755--980179169
dehydroascorbic acidL-Dehydroascorbic acidME233861440667C05422633423173
xylulose NISTXyluloseME233750439205C00312553450173
ethanolamineEthanolamineME233857700C00189343800174
pyruvic acidPyruvic acidME2337831060C00022211668174
methionineMethionineME2338076137C00073483560176
glycolic acidGlycolic acidME233838757C00160227636177
propane-1,3-diol NISTPropane-1,3-diolME23378510442C02457214380177
benzoic acidBenzoic acidME233874243C00180338990179
nicotinamideNiacinamideME233800936C00153469827179
asparagineAsparagineME2338776267C00152553078188
ureaUreaME2337581176C00086328888189
oxalic acidOxalic acidME233796971C00209260513190
3-hydroxybutyric acid3-Hydroxybutyric acidME23389292135C01089278829191
lactic acidLactic acidME233823612C01432217657191
lactoseLactoseME233821440995C00243935640191
N-acetyl-D-galactosamineN-Acetyl-D-galactosamineME233804--723255202
tryptophanTryptophanME2337636305C00078780482202
alpha-D-galactoseHexoseME233882206C00738649148204
beta-gentiobiosebeta-GentiobioseME233872441422C08240965404204
levoglucosanGlucosanME2338182724705-569637204
maltoseMaltoseME233811439186C00208946601204
shikimic acidShikimic acidME2337748742C00493611100204
glycerolGlycerolME233841753C00116344466205
mannoseMannoseME23380918950C00159645856205
ethanol phosphate NISTEthylphosphateME233858--317291211
glutathioneGlutathioneME233842124886C00051761296213
cholestan-3-olEpi-cholestanolME23386966066C129781082070215
N-acetylglutamateN-Acetylglutamic acidME23380270914C00624604748216
1,5-anhydroglucitol1,5-AnhydrosorbitolME23389964960C07326633969217
glucoheptuloseGlucoheptuloseME2338505459879C02076828606217
glucose-1-phosphateGlucose 1-phosphateME23384765533C00103594647217
hexitolSorbitolME233835453C00392704741217
hexonic acidGluconic acidME233834604-698302217
lyxitolL-ArabitolME233814439255C00532573587217
ribitolRibitolME233781827C00474575497217
riboseRiboseME2337795779C00121553135217
sorbitolSorbitolME2337735780C00794667922217
UDP-glucuronic acidUDP-glucuronic acidME23376117473C00167587601217
uridineUridineME2337566029C00299861508217
xylitolXylitolME2337516912C00379567437217
aminomalonateAminomalonic acidME233881100714C00872455754218
phenylalaninePhenylalanineME2337906140C00079537804218
serineSerineME2337755951C00065395020218
threonineThreonineME2337656288C00188409568218
tyrosineTyrosineME2337626057C00082671252218
cysteineCysteineME2338645862C00097500158220
cysteine-glycineCys-GlyME233863439498C01419715335220
UDP-N-acetylglucosamineUDP-N-acetylglucosamineME233760445675C00043625003226
3-phosphoglycerate3-Phosphoglyceric acidME233891724C00597610734227
sulfuric acidTG 16:0_18:1_18:1ME2337681118C00059285430227
inosineInosineME2338276021C00294897184230
aspartic acidAspartic acidME2338765960C00049480387232
beta-glutamic acidIsoglutamic acidME23387173064C05574525547232
malic acidMalic acidME233812525C00711463180233
5'-deoxy-5'-methylthioadenosine5'-MethylthioadenosineME233890439176C00170967036236
adenosineAdenosineME23388860961C00212918039236
tocopherol alpha-alpha-TocopherolME233764638015C003761067809237
2,5-dihydroxypyrazine NIST2,5-DihydroxypyrazineME23390023368901-397526241
uracilUracilME2337591174C00106385816241
fumaric acidFumaric acidME233853444972C00122390775245
glutamic acidGlutamic acidME23384533032C00025529100246
2-hydroxyglutaric acid2-Hydroxyglutaric acidME23389543C02630506306247
succinic acidSuccinic acidME2337701110C00042370608247
beta-alaninebeta-AlanineME233873239C00099435564248
glycineGlycineME233839750C00037368707248
chlorogenic acidChlorogenic acidME2338701794427C008521051615255
allantoic acidAllantoic acidME233884203C00499723539259
alpha-aminoadipic acidalpha-Aminoadipic acidME23388392136C00956574115260
glutaric acidGlutaric acidME233843743C00489421596261
adenineAdenineME233889--646701264
hypoxanthineHypoxanthineME233828790C00262619128265
sucroseSucroseME2337695988C00089915139271
citric acidCitric acidME233866311C00158617342273
hydroxycarbamate NISTHydroxycarbamic acidME23383016639161-325948278
pentonic acid-ME23379110264-596671292
ribonic acidRibonic acidME2337805460677C01685597646292
threonic acidThreonic acidME2337665460407C01620497572292
phosphoethanolaminePhosphoethanolamineME2337881015C00346604335299
phosphogluconic acidPhosphogluconic acidME23378791493C00345847013299
myo-inositolMyo-inositolME233806892C00137730022305
fructoseFructoseME233856439709C02336639442307
palmitoleic acidPalmitoleic acidME233793445638C08362704511311
palmitic acidPalmitic acidME233794985C00249713809313
phosphatePhosphoric acidME2337891004C00009345365314
adenosine-5-monophosphateAMPME2338876083C000201041375315
fructose-6-phosphateFructose 6-phosphateME233854440641C05345804279315
inositol-4-monophosphateInositol 4-phosphateME233825440043C03546845976315
ribose-5-phosphateRibose 5-phosphateME233778439167C00117731837315
glucoseGlucoseME23384864689C00221659798319
n-acetyl-d-hexosamineN-AcetylhexosamineME23380324139C03878746341319
N-acetylmannosamineN-Acetyl-mannosamineME233801439281C00645722897319
guanosineGuanosineME2338376802C00387954962324
xanthosineXanthosineME23375264959C01762926133325
taurineTaurineME2337671123C00245556690326
ascorbic acidVitamin CME23387854670067C00072672898332
gluconic acidGluconic acidME2338496857417C00800693148333
saccharic acidGlucaric acidME23377633037C00818699211333
xanthineXanthineME2337531188C00385701688353
glycerol-alpha-phosphatesn-Glycero-3-phosphateME233840754C03189590747357
ribulose-5-phosphateRibulose 5-phosphateME233777439184C00199735908357
1-kestose1-KestoseME233898440080C036611123027361
lactitolLactitolME233822157355C13542959541361
maltotrioseMaltotrioseME233810439586C018351176044361
melibioseMelibioseME233808440658C05402988497361
raffinoseRaffinoseME233782439242C004921120886361
cis-gondoic acidcis-Gondoic acidME2338675282768C16526847372367
fructose-1-phosphateFructose 1-phosphateME233855439394C01094803180387
galactose-6-phosphateGalactose 6-phosphateME233852439404C01113828102387
glucose-6-phosphateGlucose 6-phosphateME2338465958C00092818275387
hexose-6-phosphateHexose 6-phosphateME233833208C02965806282387
uric acidUric acidME2337571175C00366731038441
pyrophosphatePyrophosphateME2337841023C00013547021451
arachidonic acidArachidonic acidME233879444899C0021983433991
doconexent NISTDHAME233859--90281991
squaleneSqualeneME233772638072C0075197623795


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