Return to study ST003653 main page

Analysis: HILIC POSITIVE ION MODE (View original submitter results)

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
4-Hydroxyisoleucine4-HydroxyisoleucineME950796-C208028.34148.097369
Acetyl-L-carnitineCAR 2:0ME950797-C025717.22204.123584
AdenineAdenineME950798-C001474.72136.06232
AdenosineAdenosineME950799-C002124.46268.10458
Adenosyl HomocysteineS-AdenosylhomocysteineME950800-C0002110.85385.129416
Adenosyl MethionineS-AdenosylmethionineME950801-C0001913.01399.145066
AlanineAlanineME950839-C0004111.390.055504
ArginineArginineME950802-C0006217.93175.119501
ArsenobetaineArsenobetaineME950803-C193317.06179.005326
AsparagineAsparagineME950804-C0015211.86133.061318
Aspartic acidAspartic acidME950805-C0004912.86134.045334
beta-Alaninebeta-AlanineME950806-C0009911.3990.055504
Butyryl-L-carnitineCAR 4:0ME950808--4.47232.154884
CarnitineCarnitineME950809-C0048710.21162.113019
ChitobioseN,N'-DiacetylchitobioseME950810-C0167410.21425.177138
CreatineCreatineME950811-C0030011.34132.077302
CystathionineCystathionineME950812-C0229113.14223.075255
CytosineCytosineME950813-C003807.41112.051087
DeoxyadenosineDeoxyadenosineME950814-C005593.44252.109665
Dimethylsulfonioacetate (DMS-Ac)(Dimethylsulfonio)acetateME950815-C033928.39121.032327
DMSPS,S-Dimethyl-beta-propiothetinME950816-C040229.325135.047977
EctoineEctoineME950817-C062319.25143.082053
GlucosylglycerolGlucosylglycerolME950818-C1154610.1255.107995
Glutamic acidGlutamic acidME950819-C0002512.41148.060984
GlutamineGlutamineME950820-C0006411.7147.076968
GlycineGlycineME950821-C0003711.5176.039854
Glycine betaineBetaineME950807-C007197.86118.086804
GonyolGonyolME950822--10.74179.074191
GuanineGuanineME950823-C002428.61152.057235
GuanosineGuanosineME950824-C003879.06284.099495
HomarineHomarineME950825--6.19138.055503
HypotaurineHypotaurineME950826-C0051911.36110.027576
LeucineLeucineME950840-C001237.63132.102454
LysineLysineME950827-C0004717.5147.113353
MethionineMethionineME950841-C000737.96150.058876
Methionine SulfoxideMethionine sulfoxideME950828-C029899.73166.053791
ProlineProlineME950842-C001489.49116.071154
Propionyl-L-carnitineCAR 3:0ME950829-C030175.63218.139234
SarcosineSarcosineME950830-C0021310.690.055504
Stachydrine hydrochlorideStachydrineME950831-C101727.18144.102454
ThreonineThreonineME950832-C0018810.92120.066069
trans Hydroxyl prolinecis-3-HydroxyprolineME950833-C0115710.07132.066069
TrigonellineTrigonellineME950834-C010048.36138.055503
Trimethylamine N-oxideTrimethylamine N-oxideME950835-C011046.5976.076239
TuricineTuricineME950836-C215138.48160.097369
TyrosineTyrosineME950837-C000829.76182.081719
Vitamin B3Nicotinic acidME950838-C002532.68124.039854


Analysis: HILIC NEGATIVE ION MODE (View original submitter results)

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
AllopurinolAllopurinolME950843--4.16135.030686
Amino Propanesulfonic AcidCerebrilME950844-C0334911.49138.022491
AMPAMPME950867-C0002011.585346.055262
Cysteic AcidCysteic acidME950868-C0050612.15167.996671
DHPS(2R)-3-sulfopropanediolME950845-C1967510.67155.001422
Ethanesulfonic AcidEthanesulfonic acidME950846--4.29108.995942
Ethyl DihydroxybenzoateProtocatechuic acid ethyl esterME950847--2.08181.050085
Fructose 6 phosphateFructose 6-phosphateME950848-C0008513.51259.021897
Gluconic AcidGluconic acidME950849-C0025710.79195.05048
Glucose 1 phosphateGlucose 1-phosphateME950850-C0010313.45259.021897
Glucose 6 phosphateGlucose 6-phosphateME950851-C0009214.12259.021897
glycerol 3 phosphatesn-Glycero-3-phosphateME950852-C0009313.065171.005853
InosineInosineME950853-C002947.57267.072946
Isethionic Acid2-HydroxyethanesulfonateME950869-C051237.2124.990857
Ketoglutaric Acid2-Oxoglutaric acidME950854-C0002610.845145.0137
L-Pyroglutamic acidPyroglutamic acidME950855-C018797.97128.034768
Malic AcidMalic acidME950856-C0014911.97133.0137
N-acetyltaurineN-AcetyltaurineME950857--3.74166.017406
Orotic AcidOrotic acidME950858-C002954.195155.009283
Oxalic AcidOxalic acidME950859-C0020913.23588.987485
Salicylic AcidSalicylic acidME950860-C008052.2137.02387
Succinic AcidSuccinic acidME950870-C0004211.9117.018785
SucroseSucroseME950871-C0008911.93341.10839
Sulfanilic AcidSulfanilic acidME950861-C063357.23172.006841
Sulfolactic AcidSulfolactic acidME950872-C1606913.275168.980687
TaurineTaurineME950862-C0024511.13124.006841
ThymidineThymidineME950863-C002143.27241.082448
ThymineThymineME950864-C001783.02125.035103
TrehaloseTrehaloseME950873-C0108313341.10839
UDP-glucosamineUDP-glucosamineME950865-C0004312.75606.073753
UridineUridineME950866-C002996.02243.061713


Analysis: Reversed phase POSITIVE ION MODE (View original submitter results)

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
AgmatineAgmatineME950874-C001790.62131.129671
CholineCholineME950875-C001140.69104.107539
Domoic AcidDomoic acidME950876-C137322.72312.144714
Isobutyryl-L-carnitineCAR 3:0;2MeME950877--1.3232.154884
MethylthioadenosineMethylthioadenosineME950878-C001702.1298.097387
PhenylalaninePhenylalanineME950881-C000791.15166.086804
PyridoxaminePyridoxamineME950879-C005340.65169.097703
TryptophanTryptophanME950882-C000782.07205.097703
XanthineXanthineME950880-C003851.11153.041251


  logo