Return to study ST002539 main page

Analysis: HILIC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
(3-Carboxypropyl)trimethylammonium (TMAB)-ME616056-cpd:C01181-146.118104
4-Hydroxyisoleucine-ME616058-cpd:C20802-148.097369
6-Methyladenine6-MethyladenineME616059-cpd:C08434-150.07797
Acetyl-L-carnitineCAR 2:0ME616060439756cpd:C02571-204.123584
AdenineAdenineME616061190cpd:C00147-136.06232
AdenosineAdenosineME61606260961cpd:C00212-268.10458
Adenosyl HomocysteineS-AdenosylhomocysteineME616063-cpd:C00021-385.129416
AlanineAlanineME616064-cpd:C00041-90.055504
AnserineAnserineME616065112072cpd:C01262-241.130066
ArginineArginineME616066-cpd:C00062-175.119501
Argininosuccinic AcidArgininosuccinic acidME616067-cpd:C03406-291.13046
AsparagineAsparagineME616068-cpd:C00152-133.061318
Aspartic acidAspartic acidME616069-cpd:C00049-134.045334
beta-Alaninebeta-AlanineME616070239cpd:C00099-90.055504
beta-Glutamic acidIsoglutamic acidME616071-NA-148.060984
BetaineBetaineME616072-cpd:C00719-118.086804
BetonicineBetonicineME616073164642cpd:C08269-160.097369
CarnitineCarnitineME616074288cpd:C00487-162.113019
ChitobioseN,N'-DiacetylchitobioseME616075-cpd:C01674-425.177138
CholineCholineME616076305cpd:C00114-104.107539
CitrullineCitrullineME6160779750cpd:C00327-176.103517
CreatineCreatineME616078586cpd:C00300-132.077302
Cys-GlyCys-GlyME616079-cpd:C01419-179.04904
CystathionineCystathionineME616080439258cpd:C02291-223.075255
CystineCystineME61608167678cpd:C00491-241.031677
CytidineCytidineME6160826175cpd:C00475-244.093347
CytosineCytosineME616083597cpd:C00380-112.051087
DeoxyadenosineDeoxyadenosineME616084-cpd:C00559-252.109665
Dimethylsulfonioacetate (DMS-Ac)(Dimethylsulfonio)acetateME616085-cpd:C03392-121.032327
DMSPS,S-Dimethyl-beta-propiothetinME616086-cpd:C04022-135.047977
EctoineEctoineME616087126041cpd:C06231-143.082053
GlucosylglycerolGlucosylglycerolME616088-cpd:C11546-255.107995
Glutamic acidGlutamic acidME616089-cpd:C00025-148.060984
GlutamineGlutamineME616090-cpd:C00064-147.076968
Glutathione DisulfideOxidized glutathioneME616091-cpd:C00127-613.159793
Glycerophosphocholinesn-Glycero-3-phosphocholineME616092-cpd:C00670-258.110652
GlycineGlycineME616093750cpd:C00037-76.039854
GonyolGonyolME616094-NA-179.074191
GuanineGuanineME616095135398634cpd:C00242-152.057235
GuanosineGuanosineME616096135398635cpd:C00387-284.099495
HistidineHistidineME616097-cpd:C00135-156.077302
HomarineHomarineME6160983620NA-138.055503
HomoserineHomoserineME61609912647cpd:C00263-120.066069
HypotaurineHypotaurineME616100107812cpd:C00519-110.027576
HypoxanthineHypoxanthineME616101135398638cpd:C00262-137.046336
(Iso)leucineIsoleucineME616057-cpd:C00407-132.1025
LysineLysineME616102-cpd:C00047-147.113353
MethionineMethionineME616103-cpd:C00073-150.058876
Methionine SulfoxideMethionine sulfoxideME616104-cpd:C02989-166.053791
Methylmalonyl carnitineCAR DC3:0;2MeME61610591825610NA-262.129063
Muramic AcidMuramic acidME616106441038cpd:C06470-252.108329
N-AcetylglucosamineN-Acetyl-D-glucosamineME616108-cpd:C00140-222.097764
N-Acetyl-SerineN-AcetylserineME616107-cpd:C00979-148.060984
N(e)-Acetyl-LysineN6-AcetyllysineME61610992832cpd:C02727-189.123918
Ophthalmic AcidOphthalmic acidME6161107018721cpd:C21016-290.135212
OrnithineOrnithineME6161116262cpd:C00077-133.097703
ProlineProlineME616112-cpd:C00148-116.071154
Propionyl-L-carnitineCAR 3:0ME616113-cpd:C03017-218.139234
SerineSerineME616114-cpd:C00065-106.050419
Stachydrine hydrochlorideStachydrineME616115-cpd:C10172-144.102454
Thiamine monophosphateThiamine monophosphateME6161161131cpd:C01081-345.078641
ThreonineThreonineME616117-cpd:C00188-120.066069
trans Hydroxyl prolinecis-3-HydroxyprolineME6161185810cpd:C01157-132.066069
TrigonellineTrigonellineME6161195570cpd:C01004-138.055503
Trimethylamine N-oxideTrimethylamine N-oxideME616121-cpd:C01104-76.076239
Trimethylammonium Propionate (TMAP)-ME616122-cpd:C08263-132.1018
Trimethyl-L-lysineN-6-TrimethyllysineME616120440120cpd:C03793-189.160303
TuricineTuricineME6161236560290cpd:C21513-160.097369
TyrosineTyrosineME616124-cpd:C00082-182.081719
Vitamin B3Nicotinic acidME616125938cpd:C00253-124.039854


Analysis: HILIC NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
Acetylglutamic acidN-Acetyl-mannosamineME61612670914cpd:C00624-188.055899
Aconitic Acidcis-Aconitic acidME616127643757cpd:C00417-173.008615
ADPAdenosineME616128-cpd:C00008-426.021596
Amino Propanesulfonic AcidCerebrilME616129-cpd:C03349-138.022491
AMPAMPME6161306083cpd:C00020-346.055262
cAMP3',5' cyclic AMPME616131-cpd:C00575-328.044698
cGMP3',5' cyclic GMPME616132-cpd:C00942-344.039613
Citric AcidCitric acidME616133311cpd:C00158-191.01918
Cysteic AcidCysteic acidME61613472886cpd:C00506-167.996671
Cysteinesulfinic acid3-Sulfino-alanineME6161351549098cpd:C00606-152.001756
DHAPDihydroxyacetone phosphateME616136668cpd:C00111-168.990203
DHPS(2R)-3-sulfopropanediolME616137-cpd:C19675-155.001422
Ethyl Dihydroxybenzoate-ME616138-NA-181.050085
FADFADME616139643975cpd:C00016-784.149317
Fructose 6 phosphateFructose 6-phosphateME616140-cpd:C00085-259.021897
Gluconic AcidGluconic acidME616141-cpd:C00257-195.05048
Glucose 1 phosphateGlucose 1-phosphateME616142-cpd:C00103-259.021897
Glucose 6 phosphateGlucose 6-phosphateME61614399058cpd:C00092-259.021897
glycerol 3 phosphatesn-Glycero-3-phosphateME616144754cpd:C00093-171.005853
GMPGMPME616145-cpd:C00144-362.050178
InosineInosineME616146135398641cpd:C00294-267.072946
Isethionic Acid2-HydroxyethanesulfonateME616147-cpd:C05123-124.990857
Ketoglutaric AcidOxoglutaric acidME616148-cpd:C00026-145.0137
L-Pyroglutamic acidPyroglutamic acidME616149-cpd:C01879-128.034768
N-acetyltaurineN-AcetyltaurineME616150-NA-166.017406
NADNAD+ME616151-cpd:C00003-662.101304
Orotic AcidOrotic acidME616152967cpd:C00295-155.009283
PEPPhosphoenolpyruvic acidME616153-cpd:C00074-166.974553
Phosphoglyceric AcidPhosphoglyceric acidME616154724cpd:C00597-184.985118
PropionylglycinePropionylglycineME616155-NA-130.050419
Resorcylic Acid-ME6161563469cpd:C00628-153.018785
Ribose 5 phosphateRibose 5-phosphateME616157-cpd:C00117-229.011333
TaurineTaurineME6161581123cpd:C00245-124.006841
Threonic acidThreonic acidME616159151152cpd:C01620-135.02935
UDP-glucosamineUDP-glucosamineME616160-cpd:C00043-606.073753
UDP-glucoseUDP-glucoseME616161-cpd:C00029-565.047204
UridineUridineME6161626029cpd:C00299-243.061713


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
3OC12-HSL-ME616163127864NA-298.201834
3OC8-HSL-ME616164-cpd:C11841-242.139234
3OHC12-HSL-ME616165-NA-300.217484
7-dehydrocholesterol7-DehydrocholesterolME616166439423cpd:C01164-367.336475
Adenosyl MethionineS-AdenosylmethionineME61616734755cpd:C00019-399.145066
AgmatineAgmatineME616168199cpd:C00179-131.129671
C14-HSL-ME616169-NA-312.253869
Carotenebeta-CaroteneME6161705280489cpd:C02094-536.4382
DesthiobiotinDethiobiotinME616171643cpd:C01909-215.139568
GlutathioneGlutathioneME616172124886cpd:C00051-308.091634
Hydroxo B12HydroxocobalaminME61617370678542cpd:C08230-664.7861
IAAIndoleacetic acidME616174802cpd:C00954-176.071154
Indole 3 acetamide1H-Indole-3-acetamideME616175397cpd:C02693-175.087138
Indole 3 methyl acetateIndole-3-methyl acetateME616176-cpd:C20635-190.086804
Isobutyryl-L-carnitineCAR 3:0;2MeME616177-NA-232.154884
KynurenineKynurenineME616178161166cpd:C00328-209.092618
Methylthioadenosine5'-MethylthioadenosineME616179-cpd:C00170-298.097387
PhenylalaninePhenylalanineME616180-cpd:C00079-166.086804
PyridoxalPyridoxalME6161811050cpd:C00250-168.066069
RP B12-ME6161825311498cpd:C02823-678.2894
Sulfurol5-(2-Hydroxyethyl)-4-methylthiazoleME616183-cpd:C04294-144.048311
TryptophanTryptophanME616184-cpd:C00078-205.097703
Vitamin B1ThiamineME6161851130cpd:C00378-265.112308
Vitamin B2RiboflavinME616186493570cpd:C00255-377.146111
Vitamin B5Pantothenic acidME6161876613cpd:C00864-220.118498
Vitamin B6PyridoxineME6161881054cpd:C00314-170.081719
XanthineXanthineME6161891188cpd:C00385-153.041251


Analysis: Reversed phase NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
Arachidonic acidArachidonic acidME616190444899cpd:C00219-303.2324
Docosahexaenoic acidDocosahexaenoic acidME616191445580cpd:C06429-327.2324
Eicosapentaenoic acidEicosapentaenoic acidME616192446284cpd:C06428-301.2168


  logo