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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
C26 IST-ME228406--100690087
chlorogenic acid majorChlorogenic acidME228402--1052900345
C28 IST-ME228405--106170087
alpha tocopherolalpha-TocopherolME228424--1066947237
cholesterolCholesterolME228401--1077048129
C30 IST-ME228404--111310087
2-hydroxypyridine2-HydroxypyridineME228427--205669152
lactic acidLactic acidME228380--219176117
cyclohexylamine 1tmsCyclohexylamineME228398--227703128
glycolic acidGlycolic acidME228384--229350177
enolpyruvate nistPhosphoenolpyruvic acidME228396--235895147
alanineAlanineME228425--244959116
maleimideMaleimideME228375--244991154
2-hydroxybutanoic acid2-Hydroxybutyric acidME228429--259826131
oxalic acidOxalic acidME228366--260471147
C08 IST-ME228416--26232087
beta-hydroxybutyric acid3-Hydroxybutyric acidME228417--280289147
valineValineME228338--315026144
C09 IST-ME228415--32312087
ureaUreaME228340--329250100
benzoic acidBenzoic acidME228418--338781179
serine minorSerineME228351--339553116
glycerolGlycerolME228386--346514205
phosphatePhosphoric acidME228358--347293299
leucineLeucineME228378--347456158
2-deoxyerythritol2-DeoxyerythritolME228430--356911117
isoleucineIsoleucineME228381--360577158
threonine minorThreonineME228345--361462117
prolineProlineME228355--365741142
glycineGlycineME228385--370374174
succinic acid_R2Succinic acidME228348--371270129
succinic acid_R1Succinic acidME228347--371358147
C10 IST-ME228414--38102087
uracilUracilME228341--386386241
serineSerineME228352--396979204
pelargonic acidPelargonic acidME228362--399814215
threonineThreonineME228346--411756218
aspartate minorAspartic acidME228419--433670160
aminomalonic acidAminomalonic acidME228422--457163218
trans-4-hydroxy-L-proline minor1trans-4-HydroxyprolineME228344--460442158
malic acidMalic acidME228374--464809233
1,5-anydroglucitol1,5-AnhydrosorbitolME228433--478276101
salicylic acidSalicylic acidME228353--481513267
oxoprolineOxoprolineME228365--486729156
C12 IST-ME228413--48722087
glutamic acid 2TMSGlutamic acidME228388--489269174
phenylalanine minorPhenylalanineME228359--502745120
creatine major dehydrated TMS3CreatineME228399--503755115
alpha-ketoglutarate2-Oxoglutaric acidME228423--508594198
2-hydroxyglutaric acid2-Hydroxyglutaric acidME228428--508940247
phenylalaninePhenylalanineME228360--538950218
N-acetyl-L-aspartic acid 1N-Acetylaspartic acidME228371--548361158
lauric acidLauric acidME228379--548858117
ribitolRibitolME228354--577367217
C14 IST-ME228412--58262087
glutamine 3TMS majorGlutamineME228387--601223156
shikimic acidShikimic acidME228350--613725204
citric acidCitric acidME228400--619803273
ornithine 4TMSOrnithineME228367--621417142
pinitol (put by literature Tree Physiol)PinitolME228356--626923260
myristic acidMyristic acidME228372--634958285
1,5-anhydroglucitol1,5-AnhydrosorbitolME228434--635618217
fructoseFructoseME228395--640102217
phthalate ester-ME228357--644918149
fructose 2FructoseME228394--645861217
glucose_R3GlucoseME228392--651462319
glucose_R1GlucoseME228390--654228205
glucose_R2GlucoseME228391--654346319
histidine 2HistidineME228382--664188154
lysineLysineME228376--665216156
C16 IST-ME228411--66872087
tyrosineTyrosineME228342--672235218
pentadecanoic acidPentadecylic acidME228361--675295299
palmitoleic acidPalmitoleic acidME228363--706886129
palmitic acidPalmitic acidME228364--714386117
uric acidUric acidME228339--731820441
C18 IST-ME228410--74742087
heptadecanoic acidMargaric acidME228383--751505117
octadecanolStearyl alcoholME228370--755925327
linoleic acidLinoleic acidME228377--777348337
oleic acidOleic acidME228368--779249339
tryptophanTryptophanME228343--780426202
stearic acidStearic acidME228349--788356117
cystineCystineME228397--805427218
fructose-6-phosphate 2Fructose 6-phosphateME228393--807433459
glucose-6-phosphate majorGlucose 6-phosphateME228389--812999387
C20 IST-ME228409--81962087
arachidonic acidArachidonic acidME228420--837115108
monomyristinMG 14:0ME228373--838994343
arachidiic acidArachidic acidME228421--856790117
C22 IST-ME228408--88662087
z dioctylphtalate-ME228337--891860149
2-monopalmitinMG 0:0/16:0/0:0ME228426--892167218
1-monopalmitinMG 16:0/0:0/0:0ME228432--902507371
octadecylglycerolMG O-18:0ME228369--930774205
cellobioseCellobioseME228403--936208204
C24 IST-ME228407--94882087
1-monostearinMG 18:0/0:0/0:0ME228431--960911399


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