Return to study ST002687 main page

Analysis: Reversed phase POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
2-piperidinone2-PiperidinoneME635310--3.04100.075276
3-hydroxyphenyl-valerate3-Hydroxyphenyl valeric acidME635331--9.19195.101476
3-indolepropionate3-Indolepropionic acidME635330--6.67190.086276
5'-methylthioadenosine5'-MethylthioadenosineME635369--3.95298.097176
alpha-tocopherolalpha-TocopherolME635401--13.38431.388076
Asp-LeuAsp-LeuME635352--3.3247.128076
benzylbutylphthalateBenzyl butyl phthalateME635376--10.23313.145476
bis(2-ethylhexyl)phthalateBis(2-ethylhexyl)phthalateME635392--11.89391.284476
Car(10:0)CAR 10:0ME635378--7.99316.248876
Car(10:0-OH)CAR 10:0;OHME635381--7.2332.243276
Car(10:1)CAR 10:1ME635377--7.53314.232976
Car(11:0)CAR 11:0ME635379--8.46330.264076
Car(12:0)CAR 12:0ME635383--8.86344.280576
Car(12:1)CAR 12:1ME635382--8.42342.264176
Car(14:0)CAR 14:0ME635390--9.51372.312176
Car(14:1)CAR 14:1ME635389--9.21370.296176
Car(14:2)CAR 14:2ME635387--8.83368.280276
Car(16:0)CAR 16:0ME635397--10400.343676
Car(16:1)CAR 16:1ME635396--9.7398.327876
Car(16:2)CAR 16:2ME635395--9.4396.312076
Car(16:3)CAR 16:3ME635394--9.22394.295476
Car(18:0)CAR 18:0ME635400--10.37428.374976
Car(18:1)CAR 18:1ME635399--10.12426.359376
Car(18:2)CAR 18:2ME635398--9.87424.343576
Car(2:0)CAR 2:0ME635332--1.09204.124076
Car(20:0)CAR 20:0ME635402--10.66456.406076
Car(3:0)CAR 3:0ME635336--2.22218.139076
Car(3:0, 2-CH3)CAR 3:0;2MeME635342--3.05232.154976
Car(4:0)CAR 4:0ME635343--3.12232.155276
Car(4:0,3-CH3)CAR 4:0;3MeME635349--3.9246.170476
Car(5:0)CAR 5:0ME635351--3.96246.170576
Car(5:0) isomersCAR 5:0ME635350--3.96246.170476
Car(5:0-OH)CAR 5:0;OHME635358--2.54262.165176
Car(5:1)CAR 5:1ME635345--3.7244.154476
Car(6:0)CAR 6:0ME635355--5.03260.186976
Car(8:0)CAR 8:0ME635367--6.76288.217476
Car(8:0-OH)CAR 8:0;OHME635374--5.63304.211976
Car(8:1)CAR 8:1ME635366--6.06286.201176
Car(9:0)CAR 9:0ME635371--7.43302.232676
carnitineCarnitineME635325--0.64162.111576
cholesterol (-H2O)CholesterolME635388--13.5369.352076
cholineCholineME635311--0.61104.107476
creatineCreatineME635316--0.69132.077576
cytidineCytidineME635344--0.99244.093076
deoxycholateDeoxycholic acidME635393--10.61393.299976
deoxyguanosineDeoxyguanosineME635359--2.41268.105076
DG(18:1_18:1)DG 18:1_18:1ME635425--15.61621.546676
DG(32:0)DG 32:0ME635421--15.09569.514676
DG(32:1)DG 32:1ME635420--14.3567.499076
DG(34:1)DG 34:1ME635423--15.34595.531476
DG(34:2)DG 34:2ME635422--14.6593.516276
DG(36:3)DG 36:3ME635424--14.81619.531576
diethylphthalateDiethyl phthalateME635338--8.27223.097076
FA(12:0-NH2)Aminododecanoic acidME635335--8.05216.195576
FA(16:1)Hexadecenoic acidME635353--11.1255.231876
FA(18:1)Octadecenoic acidME635365--11.72283.260176
FA(18:2)Octadecadienoic acidME635363--11.5281.245476
gamma-glutamylisoleucinegamma-GlutamylisoleucineME635356--4.17261.143776
gamma-glutamylleucinegamma-GlutamylleucineME635357--4.17261.143776
gamma-glutamyltyrosinegamma-GlutamyltyrosineME635375--3.04311.126876
glucoseGlucoseME635329--0.75181.070676
Glu-PheGlu-PheME635368--4.37295.128976
glutamineGlutamineME635321--0.61147.076376
glycocholateGlycocholic acidME635403--9.55466.316976
GMPGMPME635386--1.27364.065576
guanineGuanineME635323--1.27152.057176
hippurateHippuric acidME635328--4.35180.065776
hypoxanthineHypoxanthineME635320--1.3137.046376
Ile-IleIle-IleME635347--4.63245.185476
Ile-ProIle-ProME635339--1.73229.151676
Ile-ValIle-ValME635341--3.67231.170076
inosineInosineME635360--2.47269.088776
IsoleucineIsoleucineME635317--1.83132.101776
kynurenineKynurenineME635334--2.69209.092676
leucineLeucineME635319--1.95132.102076
leucine+ isoleucineLeucine/IsoleucineME635318--1.95132.101976
Leu-IleLeu-IleME635348--4.63245.185476
Leu-ProLeu-ProME635340--2.01229.154876
LPC(14:0)LPC 14:0ME635404--10.56468.309476
LPC(15:0)_rp_aLPC 15:0ME635406--10.83482.323576
LPC(16:0)_a_bLPC 16:0ME635409--11.04496.341476
LPC(16:0)_rp_bLPC 16:0ME635410--11.04496.341576
LPC(16:1)_rp_a_bLPC 16:1ME635408--10.73494.325376
LPC(17:0)_rp_a_bLPC 17:0ME635411--11.25510.356776
LPC(18:1)_rp_bLPC 18:1ME635414--11.16522.357276
LPC(18:2)_rp_a_bLPC 18:2ME635413--10.9520.341276
LPC(18:2)_rp_bLPC 18:2ME635412--10.9520.341176
LPC(20:0)_rp_aLPC 20:0ME635419--11.74552.402676
LPC(20:3)_rp_a_bLPC 20:3ME635418--11.45546.355076
LPC(20:3)_rp_bLPC 20:3ME635417--11.45546.354976
LPC(20:4)_rp_a_bLPC 20:4ME635415--10.81544.341276
LPC(20:4)_rp_bLPC 20:4ME635416--10.9544.341376
LPE(18:0)_rp_bLPE 18:0ME635407--11.44482.325176
LPE(18:2)_rp_bLPE 18:2ME635405--10.93478.293976
lysineLysineME635322--0.52147.112476
MG(14:0)_rp_aMG 14:0ME635373--10.98303.251976
MG(16:0)MG 16:0ME635380--11.38331.285576
MG(18:1)_rp_a_bMG 18:1ME635385--11.48357.300776
MG(18:1)_rp_bMG 18:1ME635384--11.48357.300576
monoethylhexyl phthalateMonoethylhexyl phthalic acidME635362--10.28279.159976
niacinamideNiacinamideME635315--1.35123.056076
N-undecanoylglycineNAGly 11:0ME635346--8.44244.191076
oleamideOleamideME635364--11.38282.278776
pantothenatePantothenic acidME635337--3.43220.118776
PC(28:0)PC 28:0ME635427--12.53678.506576
PC(30:0)PC 30:0ME635429--13706.539376
PC(32:0)PC 32:0ME635435--13.49734.572276
PC(32:1)PC 32:1ME635434--13.04732.556476
PC(32:2)PC 32:2ME635432--12.72730.540476
PC(33:2)PC 33:2ME635436--12.94744.552476
PC(34:1)PC 34:1ME635440--13.62760.587776
PC(34:2)PC 34:2ME635439--13.23758.572376
PC(34:3)PC 34:3ME635438--12.9756.555676
PC(34:4)PC 34:4ME635437--12.68754.539576
PC(35:2)PC 35:2ME635442--13.51772.587776
PC(35:3)PC 35:3ME635441--13.06770.567076
PC(36:2)PC 36:2ME635446--13.88786.603376
PC(36:3)PC 36:3ME635444--13.34784.587676
PC(36:4)PC 36:4ME635443--13.13782.572276
PC(38:6)PC 38:6ME635448--13.09806.572476
PC(40:6)PC 40:6ME635452--13.7834.603676
PC(40:8)PC 40:8ME635451--13.27830.568176
prolineProlineME635313--0.71116.072276
S-allylcysteineS-AllylcysteineME635324--2.41162.058776
serotoninSerotoninME635327--2.36177.102076
SM(d32:1)SM 32:1;O2ME635426--12.43675.544676
SM(d34:2)SM 34:2;O2ME635428--12.53701.561576
SM(d35:1)SM 35:1;O2ME635430--13.22717.590776
SM(d36:1)SM 36:1;O2ME635433--13.4731.608376
SM(d36:2)SM 36:2;O2ME635431--13729.591276
SM(d40:1)SM 40:1;O2ME635447--15.08787.669776
SM(d40:2)SM 40:2;O2ME635445--14.23785.651776
SM(d42:1)SM 42:1;O2ME635450--16.39815.701576
SM(d42:2)SM 42:2;O2ME635449--15.2813.686776
sn-glycero-3-phosphocholinesn-Glycero-3-phosphocholineME635354--0.78258.110576
sphinganine (C16)C16 SphinganineME635361--8.54274.274576
sphinganine (C18)SphinganineME635372--9.84302.305276
sphingosine-1P (C18)Sphingosine 1-phosphateME635391--10.66380.256376
sphingosine (C18)SphingosineME635370--9.7300.290076
tryptophanTryptophanME635333--3.62205.097276
uracilUracilME635312--1.87113.034276
urateUric acidME635326--1.26169.035676
valineValineME635314--0.78118.086676


  logo