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Return to study ST001201 main page
Analysis: pHILIC POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
1,2-Dihydroxy-5-(methylthio)pent-1-en-3-one
1,2-Dihydroxy-3-keto-5-methylthiopentene
ME283955
-
C15606
7.78455519
-
1(2H)-Phthalazinone
Azelastine
ME283983
-
C14473
7.454377472
-
2,3-Diaminosalicylic acid
2,3-Diaminosalicylic acid
ME283923
-
-
8.98651063
-
2,3-Dihydro-2,3-dihydroxybenzoate
-
ME283639
-
C04171
13.82792372
-
2,3-Dimethylmaleate
Dimethyl maleate
ME283979
-
C00922
15.6800528
-
(24R,24'R)-Fucosterol epoxide
(3beta,24R,24'R)-Fucosterol epoxide
ME283924
-
C03910
3.964653498
-
2,6-Diamino-7-hydroxy-azelaic acid
-
ME283805
-
C12025
17.6226096
-
2-acetamidoglucal
-
ME283773
-
-
14.77736235
-
2-Amino-2-deoxy-D-gluconate
Glucosaminic acid
ME283643
-
C03752
16.82624778
-
2-amino-3,7-dideoxy-D-threo-hept-6-ulosonate
-
ME283633
-
-
12.57952902
-
2-chloro-3-methyl-maleylacetate
-
ME283691
-
-
17.31114918
-
2-Furoate
2-Furoic acid
ME283625
-
C01546
11.82057362
-
2-Hydroxy-2,4-pentadienoate
2-Hydroxypenta-2,4-dienoic acid
ME284008
-
C00596
15.64217261
-
2-hydroxy-3-carboxy-4,5-cyclopropylhex-5-enoate
-
ME283771
-
-
13.98067225
-
2-Methylbutyroylcarnitine
CAR 4:0;2Me
ME283892
-
-
8.03945883
-
2-oxo-5-methylthiopentanoic-acid
-
ME283755
-
C17211
12.79748973
-
2-Oxoadipate
Oxoadipic acid
ME283632
-
C00322
11.81325703
-
2-Quinolinecarboxylic acid
Quinaldic acid
ME284011
-
C06325
7.123976115
-
(2S)-2-Isopropyl-3-oxosuccinate
2-Isopropyl-3-oxosuccinate
ME283683
-
C04236
15.91119186
-
2-S-Glutathionyl acetate
-
ME283655
-
C14862
16.19443587
-
3',5'-Cyclic CMP
3',5'-cyclic CMP
ME283840
-
C00941
13.44993932
-
3-(ADP)-2-phosphoglycerate
-
ME283967
-
C03673
17.53591505
-
3beta-Hydroxy-4beta-methyl-5alpha-cholest-7-ene-4a...
3-beta-Hydroxy-4-beta-methyl-5-alpha-cholest-7-ene-4-alpha-carboxylate
ME283716
-
C04840
3.947410372
-
3-Butynoate
3-Butynoic acid
ME283841
-
C06144
10.98414413
-
3-Dehydroxycarnitine
3-Dehydroxycarnitine
ME283847
-
C05543
9.658385197
-
3-deoxy-D-galactose
3-Deoxygalactose
ME283627
-
-
12.21514739
-
3-Ethylmalate
-
ME283656
-
C01989
12.56533951
-
3-Hydroxy-N6,N6,N6-trimethyl-L-lysine
3-Hydroxy-N6,N6,N6-trimethyl-lysine
ME283921
-
C01259
19.87136733
-
3-Methyl-2-oxobutanoic acid
Ketoisovaleric acid
ME283692
-
C00141
13.83645636
-
3-Methyleneoxindole
3-Methyleneoxindole
ME284004
-
C02796
7.4858709
-
4a-Hydroxytetrahydrobiopterin
4a-Hydroxytetrahydrobiopterin
ME283807
-
C15522
14.01664986
-
4-amino-4-deoxy-L-arabinose
-
ME283882
-
-
15.55624823
-
4-Aminobenzoate
p-Aminobenzoic acid
ME283699
-
C00568
11.76703618
-
4-Aminobutanal
4-Aminobutyraldehyde
ME283676
-
C00555
10.58849705
-
4-Hydroxy-4-methylglutamate
(2S,4S)-4-Amino-2-hydroxy-2-methylpentanedioic acid
ME283782
-
C06034
12.92643181
-
4-(Trimethylammonio)but-2-enoate
(E)-4-(Trimethylammonio)but-2-enoate
ME283717
-
C04114
10.69542471
-
4-Trimethylammoniobutanoate
3-Dehydroxycarnitine
ME283820
-
C01181
13.28178434
-
5,6-Dihydrothymine
Dihydrothymine
ME283697
-
C00906
14.58825594
-
5-6-Dihydrouridine
5,6-Dihydrouridine
ME283668
-
-
10.43779594
-
5,8,13,13a-Tetrahydrocolumbamine
(S)-Tetrahydrocolumbamine
ME283623
-
C04118
10.86619738
-
5-Acetamidopentanoate
5-Acetamidovaleric acid
ME283780
-
C03087
12.44322278
-
5-Aminolevulinate
5-Amino-levulinic acid
ME283776
-
C00430
14.294225
-
5'-deoxy-5'-fluoroadenosine
5'-Deoxy-5'-fluoroadenosine
ME283789
-
-
16.0682009
-
5'-Methylthioadenosine
5'-Methylthioadenosine
ME283992
-
C00170
7.44925675
-
5-Nitro-2-(3-phenylpropylamino)benzoic acid
NPPB
ME283833
-
C13705
4.920204915
-
(+/-)-5-[(tert-Butylamino)-2'-hydroxypropoxy]-1,2,...
-
ME283990
-
C04875
4.120055973
-
6,7-Dimethyl-8-(1-D-ribityl)lumazine
6,7-Dimethyl-8-(1-D-ribityl)lumazine
ME283856
-
C04332
12.89729971
-
6-Acetamido-2-oxohexanoate
2-Keto-6-acetamidocaproic acid
ME283930
-
C05548
7.464742888
-
6-Acetyl-D-glucose
6-Acetylglucose
ME283814
-
C02655
13.99668527
-
6-deoxy-5-ketofructose-1-phosphate
-
ME283858
-
-
15.03237482
-
6-Hydroxyl-1,6-dihydropurine ribonucleoside
6-Hydroxyl-1,6-dihydropurine ribonucleoside
ME283679
-
C04583
14.61654433
-
(6R)-6-(L-Erythro-1,2-Dihydroxypropyl)-5,6,7,8-tet...
-
ME284000
-
C06486
12.13497894
-
8-Amino-7-oxononanoate
8-Amino-7-oxononanoic acid
ME283800
-
C01092
11.71132789
-
Acetylcaranine
Acetylcaranine
ME283652
-
C08513
12.44414678
-
Acetyl-CoA
Acetyl-CoA
ME283946
-
C00024
12.25343995
-
Acetyl phosphate
Acetylphosphate
ME283995
-
C00227
17.85571837
-
Adenine
Adenine
ME283956
-
C00147
9.635439528
-
Adenosine
Adenosine
ME283842
-
C00212
9.128350075
-
ADP
ADP
ME283914
-
C00008
14.88678301
-
ADP ribose 1'',2''-phosphate
-
ME283745
-
-
17.90836147
-
Ala-Ala-Ala-Ser
-
ME283684
-
-
15.99362405
-
Ala-Asn-Asn-Ser
-
ME283852
-
-
16.81813075
-
Ala-Asn-Asp
Ala-Asn-Asp
ME283803
-
-
15.25765742
-
Ala-Asn-Pro
Ala-Asn-Pro
ME283659
-
-
16.54631074
-
Ala-Asp-Asp
Ala-Asp-Asp
ME283658
-
-
16.56375793
-
Ala-Asp-Asp-Asp
-
ME283825
-
-
17.99750422
-
Ala-Asp-Asp-Cys
-
ME283783
-
-
15.96775415
-
Ala-Asp-Asp-His
-
ME283829
-
-
15.65633248
-
Ala-Asp-Cys-Ser
-
ME283835
-
-
17.09178532
-
Ala-Asp-Gly-Arg
-
ME283815
-
-
15.73099631
-
Ala-Asp-Gly-Tyr
-
ME283700
-
-
11.4054367
-
Ala-Cys-Tyr
Ala-Cys-Tyr
ME283790
-
-
11.64355964
-
Ala-Glu-Glu-His
-
ME283819
-
-
15.33476141
-
Ala-Gly-Tyr
Ala-Gly-Tyr
ME283689
-
-
8.1245929
-
Ala-Leu-Asn-Pro
-
ME283916
-
-
9.456201698
-
Ala-Leu-Lys-Asp
-
ME283657
-
-
13.29468349
-
Ala-Leu-Thr-Ala
-
ME283911
-
-
14.43704687
-
Ala-Leu-Trp-Ser
-
ME284003
-
-
7.461253865
-
Ala-Lys-Asp-Gly
-
ME283640
-
-
15.99201105
-
Ala-Met-Asp-Tyr
-
ME283880
-
-
10.53066296
-
Ala-Met-Trp-Asp
-
ME283971
-
-
16.69371387
-
Ala-Pro
Ala-Pro
ME283735
-
-
11.28216209
-
Ala-Thr-Ala-Asp
-
ME283674
-
-
17.07633168
-
Ala-Thr-Ala-Ser
-
ME283851
-
-
16.36399875
-
Ala-Thr-Gln-Pro
-
ME283688
-
-
16.70107265
-
Ala-Val-Asp-Ser
-
ME283750
-
-
16.8841937
-
alpha,beta-Didehydrotryptophan
alpha,beta-Didehydrotryptophan
ME283998
-
C06732
9.934655003
-
Anthocyanin 3'-O-beta-D-glucoside
Anthocyanin 3'-O-beta-D-glucoside
ME283794
-
C15550
13.48960909
-
Arg-Asp-Asp-Gly
-
ME283897
-
-
16.99528647
-
Asn-Asn-Gln-Ser
-
ME283649
-
-
17.7605817
-
Asn-Asp
Asn-Asp
ME283888
-
-
15.55122626
-
Asn-Glu-Ile-Pro
-
ME283706
-
-
12.29378375
-
Asn-Gly-Pro-Pro
-
ME283832
-
-
11.04849713
-
Asn-Leu-Lys-Asp
-
ME283961
-
-
13.25466819
-
Asn-Leu-Pro-Pro
-
ME283968
-
-
10.79738217
-
Asn-Lys-Gly-Gly
-
ME283759
-
-
15.52600501
-
Asn-Lys-Gly-Pro
-
ME283824
-
-
15.38386607
-
Asn-Pro
Asn-Pro
ME283737
-
-
13.71528324
-
Asp-Arg
Asp-Arg
ME283729
-
-
16.35265779
-
Aspartylysine
Asp-Lys
ME283709
-
-
17.96561217
-
Asp-Asp
Asp-Asp
ME283722
-
-
17.224767
-
Asp-Asp-Gly
Asp-Asp-Gly
ME283711
-
-
18.13237352
-
Asp-Cys-Cys-Ser
S-Glutathionyl-cysteine
ME283836
-
-
16.80358335
-
Asp-Gly-Arg
Asp-Gly-Arg
ME283802
-
-
15.64488876
-
Asp-Gly-Ser
Asp-Gly-Ser
ME283662
-
-
15.57312623
-
Asp-Leu-Lys-Asp
-
ME283834
-
-
13.85608427
-
Asp-Thr-Cys-Cys
-
ME283931
-
-
16.49431003
-
beta-Citryl-L-glutamic acid
Beta-Citryl-glutamic acid
ME283726
-
-
19.92310325
-
Betaine
Betaine
ME283810
-
C00719
11.26083377
-
Biotin
Biotin
ME283781
-
C00120
8.77314082
-
Bis(2-ethylhexyl)phthalate
Bis(2-ethylhexyl)phthalate
ME283913
-
C03690
3.981728018
-
Botrydial
Botrydial
ME283917
-
C09622
4.248347527
-
Carnosine
Carnosine
ME283734
-
C00386
15.48222105
-
CDP-choline
CDP-choline
ME283831
-
C00307
15.1475652
-
CDP-ribitol
CDP-ribitol
ME283690
-
C00789
16.39915432
-
Cer(d40:2)
Cer 40:2;O2
ME283839
-
-
3.946981253
-
Cerulenin
Cerulenin
ME283957
-
C12058
10.27191053
-
Choline
Choline
ME283867
-
C00114
20.1383879
-
Choline phosphate
Choline phosphate
ME283712
-
C00588
14.75663659
-
cis-1,2-Dihydroxy-1,2-dihydrodibenzothiophene
cis-1,2-dihydroxy-1,2-dihydrodibenzothiophene
ME283724
-
C06721
13.3164968
-
CMP
CMP
ME283756
-
C00055
16.37350877
-
Creatine
Creatine
ME283811
-
C00300
14.52459568
-
Creatinine
Creatinine
ME283950
-
C00791
9.746428498
-
CTP
CTP
ME283889
-
C00063
17.97340292
-
Cys-Cys-Pro-Ser
-
ME283686
-
-
14.9682536
-
Cys-Gly-Pro
Cys-Gly-Pro
ME283883
-
-
10.49669949
-
Cys-Phe-Trp-Gly
-
ME283785
-
-
7.485764025
-
Dalpanin
Dalpanin
ME283966
-
C10416
16.4169307
-
dATP
dATP
ME283932
-
C00131
15.38599459
-
dCTP
dCTP
ME283951
-
C00458
17.14513687
-
Decanoyl-CoA
Decanoyl-CoA
ME283905
-
C05274
14.12818983
-
Deoxymannojirimycin
Deoxymannojirimycin
ME283628
-
C10141
15.69229236
-
D-Erythrose 4-phosphate
Erythrose 4-phosphate
ME283758
-
C00279
12.63337601
-
D-Glucosamine
Glucosamine
ME283826
-
C00329
16.24497644
-
dGMP
dGMP
ME283763
-
C00362
13.54287672
-
dIMP
dIMP
ME283848
-
C06196
14.47814534
-
Docosa-4-7-10-13-16-pentaenoylcarnitine
CAR 22:5
ME283997
-
-
4.511007532
-
dTDP-alpha-D-desosamine
dTDP-alpha-D-desosamine
ME283733
-
C06632
15.24609065
-
Epsilon-(gamma-Glutamyl)-lysine
Epsilon-(gamma-Glutamyl)-lysine
ME283765
-
-
15.11884275
-
Ergothioneine
Ergothioneine
ME283710
-
C05570
14.67272929
-
Ethanolamine phosphate
Phosphoethanolamine
ME283715
-
C00346
15.7223487
-
FAD
FAD
ME283642
-
C00016
11.30638605
-
FA oxo(19:0)
-
ME283665
-
-
3.974060888
-
FA oxo(21:0)
-
ME283641
-
-
3.888025637
-
[FA oxo,amino(6:0)] 3-oxo-5S-amino-hexanoic acid
(S)-5-Amino-3-oxohexanoate
ME283920
-
C03656
12.36042834
-
Febrifugine
Febrifugine
ME283903
-
C10677
8.640170365
-
formycin A
Formycin A
ME283969
-
-
13.16840677
-
Furfural
2-Furancarboxaldehyde
ME283669
-
C14279
17.62865005
-
gamma-Glutamyl-beta-cyanoalanine
gamma-Glutamyl-beta-cyanoalanine
ME283696
-
C05711
13.61914759
-
gamma-Glutamyl-Se-methylselenocysteine
gamma-Glutamyl-Se-methylselenocysteine
ME283797
-
C05695
15.92915792
-
gamma-L-Glutamyl-L-cysteine
gamma-Glutamylcysteine
ME283673
-
C00669
13.91933365
-
gamma-L-Glutamyl-L-cysteinyl-beta-alanine
Homoglutathione
ME283796
-
C04544
12.77105812
-
gamma-thiomethyl glutamate
-
ME283767
-
-
10.99869053
-
GDP
GDP
ME283901
-
C00035
17.64749103
-
Glu-Ala-Glu
Glu-Ala-Glu
ME283624
-
-
15.98694781
-
Glu-Ala-Ser
Glu-Ala-Ser
ME283902
-
-
14.49212008
-
Glu-Asp
Glu-Asp
ME283694
-
-
16.69126093
-
Glu-Asp-Asp
Glu-Asp-Asp
ME283970
-
-
18.06585883
-
Glu-Gln
Glu-Gln
ME283982
-
-
15.06846238
-
Glu-Glu-Gln-His
-
ME283844
-
-
15.89816427
-
Glu-Glu-Pro
Glu-Glu-Pro
ME283964
-
-
16.72341505
-
Glu-Gly-Ser
Glu-Gly-Ser
ME283766
-
-
15.4833589
-
Glu-His-His
Glu-His-His
ME283959
-
-
10.83197047
-
Glu-Met-Pro
Glu-Met-Pro
ME283890
-
-
9.020428322
-
Glu-Met-Ser
Glu-Met-Ser
ME283792
-
-
11.87860391
-
Glu-Met-Thr
Glu-Met-Thr
ME283635
-
-
12.04709703
-
Glu-Pro
Glu-Pro
ME283953
-
-
14.9374847
-
Glu-Ser
Glu-Ser
ME283753
-
-
15.43431405
-
Glu-Ser-Val
Glu-Ser-Val
ME283993
-
-
11.36487278
-
Glutathione disulfide
Oxidized glutathione
ME283919
-
C00127
17.2230413
-
Glu-Thr
Glu-Thr
ME283808
-
-
14.51654458
-
Glycerophosphoglycerol
sn-Glycero-3-phosphoglycerol
ME283645
-
C03274
12.52444082
-
glycerophosphoserine
sn-Glycero-3-phosphoserine
ME283942
-
-
12.07707582
-
GMP
GMP
ME283857
-
C00144
16.47749551
-
GTP
GTP
ME283947
-
C00044
18.91952913
-
Guanine
Guanine
ME283938
-
C00242
12.28298237
-
Heptadecanoylcarnitine
CAR 17:0
ME283929
-
-
4.614143477
-
Hercynine
Hercynine
ME283626
-
C05575
12.20351443
-
Hexanoylcarnitine
CAR 6:0
ME283973
-
-
7.370906528
-
His-Leu
His-Leu
ME283978
-
C05010
8.191022187
-
Homocarnosine
Homocarnosine
ME283787
-
C00884
14.15356262
-
Homostachydrine
(S)-Homostachydrine
ME283631
-
C08283
9.946982787
-
Hydroxybutyrylcarnitine
CAR 4:0;OH
ME283693
-
-
11.28447533
-
Hydroxyhexanoycarnitine
CAR 6:0;OH
ME283777
-
-
9.137908298
-
Hypaphorine
Lenticin
ME283940
-
C09213
8.738507918
-
Hypoxanthine
Hypoxanthine
ME283922
-
C00262
10.16883502
-
Ile-Ala
Ile-Ala
ME284009
-
-
7.44949461
-
Ile-Asn-Pro
Ile-Asn-Pro
ME283708
-
-
9.69912248
-
Ile-Cys-Gly
Ile-Cys-Gly
ME283963
-
-
10.91679136
-
Ile-Lys
Ile-Lys
ME284007
-
-
12.36252912
-
Ile-Lys-Pro
Ile-Lys-Pro
ME283854
-
-
21.1247737
-
Ile-Lys-Ser
Ile-Lys-Ser
ME283764
-
-
17.36197125
-
Ile-Ser
Ile-Ser
ME283986
-
-
8.163890955
-
Indole
Indole
ME283894
-
C00463
11.54874821
-
Indole-3-acetamide
1H-Indole-3-acetamide
ME284010
-
C02693
7.433293638
-
Inosine
Inosine
ME283791
-
C00294
10.8509142
-
Isoquinoline
Isoquinoline
ME284013
-
C06323
7.340176393
-
Kievitone hydrate
Kievitone hydrate
ME283728
-
C02549
10.17212536
-
Lacto-N-tetraose
Lacto-N-tetraose
ME283723
-
C06371
16.34945062
-
L-a-glutamyl-L-Lysine
-
ME283987
-
-
16.7820633
-
L-Alanine
Alanine
ME283707
-
C00041
14.59700288
-
L-Arginine
Arginine
ME283702
-
C00062
23.57424572
-
L-Asparagine
Asparagine
ME283898
-
C00152
15.11048565
-
L-beta-aspartyl-L-alanine
beta-Aspartylalanine
ME283677
-
-
15.4921686
-
L-beta-aspartyl-L-leucine
-
ME283685
-
-
12.29845396
-
L-beta-aspartyl-L-serine
-
ME283757
-
-
15.42594314
-
L-Carnitine
Carnitine
ME283828
-
C00487
13.16516467
-
L-Citrulline
Citrulline
ME283860
-
C00327
15.74513397
-
Leu-Ala
Leu-Ala
ME283660
-
-
12.69207162
-
Leu-Pro
Leu-Pro
ME283806
-
-
12.90999965
-
L-gamma-glutamyl-L-isoleucine
gamma-Glutamylisoleucine
ME283812
-
-
10.89423748
-
L-Glutamate
Glutamic acid
ME283822
-
C00025
14.4554063
-
L-Glutamine
Glutamine
ME283804
-
C00064
14.90774959
-
L-Glutamyl 5-phosphate
L-Glutamic acid 5-phosphate
ME283801
-
C03287
15.55770409
-
L-Histidine
Histidine
ME283731
-
C00135
14.58508603
-
L-Homocitrulline
Homocitrulline
ME283727
-
C02427
15.04441784
-
Linatine
Linatine
ME283896
-
C05939
11.19902369
-
Linoelaidylcarnitine
CAR 18:2(9E,12E)
ME283975
-
-
4.686103363
-
L-Isoleucine
Isoleucine
ME283887
-
C00407
10.82333916
-
L-isoleucyl-L-proline
Ile-Pro
ME283761
-
-
10.14985111
-
L-Leucine
Leucine
ME283846
-
C00123
11.27278333
-
L-Lysine
Lysine
ME283754
-
C00047
22.59069608
-
L-Methionine
Methionine
ME283768
-
C00073
11.47533895
-
L-Ornithine
Ornithine
ME283813
-
C00077
21.81506752
-
Lotaustralin
Lotaustralin
ME283736
-
C08334
12.75265628
-
L-Phenylalanine
Phenylalanine
ME283915
-
C00079
10.20099726
-
L-Pipecolate
Pipecolic acid
ME283730
-
C00408
12.38767667
-
L-Proline
Proline
ME283670
-
C00148
12.707311
-
L-Serine
Serine
ME283873
-
C00065
15.58635528
-
L-Threonine
Threonine
ME283760
-
C00188
14.25210289
-
L-Tryptophan
Tryptophan
ME283772
-
C00078
11.57293077
-
L-Tyrosine
Tyrosine
ME283863
-
C00082
12.88724525
-
L-Tyrosyl-L-arginine
Tyr-Arg
ME284012
-
C02993
14.07958258
-
L-Valine
Valine
ME283704
-
C00183
12.3807767
-
Lys-Asn-Asp
Lys-Asn-Asp
ME283647
-
-
17.52026785
-
Lys-Gly
Lys-Gly
ME283941
-
-
16.58362281
-
Lys-Gly-His
Lys-Gly-His
ME283934
-
-
15.7605982
-
LysoPC(16:0)
LPC 16:0
ME283943
-
C04230
4.866571127
-
[LysoPC(16:2)] 1-hexadecyl-sn-glycero-3-phosphocho...
LPC O-16:0
ME283933
-
C13903
4.917075635
-
LysoPC(18:0)
LPC 18:0
ME283743
-
C04230
4.743657615
-
LysoPC(18:1)
LPC 18:1
ME283936
-
-
4.78141193
-
LysoPC(20:0)
LPC 20:0
ME283939
-
C04230
4.585400215
-
LysoPC(O-16:1)
LPC O-16:1
ME283861
-
-
4.79712854
-
LysoPC(O-18:2)
LPC O-18:2
ME283739
-
C04317
4.797236827
-
LysoPE(16:0)
LPE 16:0
ME283952
-
-
4.865589345
-
LysoPE(18:0)
LPE 18:0
ME283965
-
-
4.930115503
-
LysoPE(18:1)
LPE 18:1
ME283910
-
-
4.873073178
-
LysoPE(20:0)
LPE 20:0
ME283862
-
-
4.813759438
-
LysoPE(20:4)
LPE 20:4
ME283958
-
-
4.695748682
-
Lys-Pro
Lys-Pro
ME283977
-
-
15.15665225
-
Lys-Ser
Lys-Ser
ME283999
-
-
16.42022548
-
Lys-Thr-Ser
Lys-Thr-Ser
ME283798
-
-
15.32699139
-
Lys-Val
Lys-Val
ME283818
-
-
13.67296476
-
meso-2,6-Diaminoheptanedioate
-
ME283874
-
C00680
14.06208873
-
Met-Ala
Met-Ala
ME283751
-
-
10.40121347
-
Met-Ala-Gly
Met-Ala-Gly
ME283944
-
-
12.57460062
-
Met-Asp-His
Met-Asp-His
ME283646
-
-
13.6691183
-
Methacholine
Methacholine
ME283816
-
C07471
13.25168648
-
Methyl 2-diazoacetamidohexonate
Methyl 2-diazoacetamidohexonate
ME283823
-
C01223
13.98360301
-
Met-Ser
Met-Ser
ME283948
-
-
10.40782066
-
MG(20:3)
MG 20:3
ME283972
-
-
3.99036643
-
Muramic acid
Muramic acid
ME283788
-
C06470
14.29730416
-
N2-Acetyl-L-aminoadipate
N-Acetyl-2-aminoadipic acid
ME283843
-
C12986
12.11897716
-
N2-Acetyl-L-aminoadipate semialdehyde
-
ME283654
-
C12988
7.073547548
-
N2-Acetyl-L-aminoadipyl-delta-phosphate
-
ME283878
-
C12987
16.45241424
-
N2-(D-1-Carboxyethyl)-L-arginine
D-Octopine
ME283849
-
C04137
16.99054652
-
N2-(D-1-Carboxyethyl)-L-lysine
D-Lysopine
ME283747
-
C04020
16.94750338
-
N2-Succinyl-L-ornithine
N2-Succinylornithine
ME283884
-
C03415
13.22251466
-
N4-Acetylaminobutanal
N4-Acetylaminobutanal
ME283864
-
C05936
7.66539196
-
N4-(Acetyl-beta-D-glucosaminyl)asparagine
Aspartylglycosamine
ME283752
-
C04540
15.78331649
-
N5-acetyl-N5-hydroxy-L-ornithine
2,6-Diaminopimelic acid
ME283875
-
-
11.8733083
-
N5-(L-1-Carboxyethyl)-L-ornithine
N(6)-Acetyl-N(6)-hydroxy-lysine
ME283687
-
C04210
17.68569405
-
N6-(1,2-Dicarboxyethyl)-AMP
Adenylsuccinic acid
ME283830
-
C03794
18.12390048
-
N6-Acetyl-L-lysine
N6-Acetyllysine
ME283644
-
C02727
12.1397867
-
N6-Acetyl-N6-hydroxy-L-lysine
N(6)-Acetyl-N(6)-hydroxy-lysine
ME283926
-
C03955
11.82878045
-
N6-(L-1,3-Dicarboxypropyl)-L-lysine
Saccharopine
ME283719
-
C00449
15.4724726
-
N6,N6,N6-Trimethyl-L-lysine
N-6-Trimethyllysine
ME283925
-
C03793
21.3936985
-
N-Acetoxyarylamine
N-(Acetyloxy)benzenamine
ME283907
-
C02709
5.205203595
-
N-Acetyl-D-glucosamine
N-Acetylglucosamine
ME283845
-
C00140
13.60695738
-
N-acetyl -D- glucosaminitol
N-Acetyl-glucosaminitol
ME283879
-
-
12.00662423
-
N-Acetyl-D-mannosamine
N-Acetyl-mannosamine
ME283714
-
C00645
12.1311889
-
N-Acetyllactosamine
N-Acetyllactosamine
ME283838
-
C00611
13.62439152
-
N-Acetyl-L-leucine
N-Acetylleucine
ME283870
-
C02710
11.77492299
-
N-Acetylputrescine
N-Acetylputrescine
ME283869
-
C02714
18.89224857
-
NAD+
NAD
ME283718
-
C00003
13.93928822
-
NADP+
NADP
ME283895
-
C00006
16.57570596
-
N-Carbamoyl-L-aspartate
Carbamoylaspartate
ME283629
-
C00438
16.5128403
-
N-Carbamyl-L-glutamate
Carglumic acid
ME283908
-
C05829
15.2242112
-
N-Carboxyethyl-g-aminobutyricacid
N-Carboxyethyl-gamma-aminobutyric acid
ME283793
-
-
13.0563197
-
Nebrosteroid M
Nebrosteroid M
ME283945
-
-
3.994274657
-
Ne,Ne dimethyllysine
N(6),N(6)-Dimethyl-lysine
ME283900
-
C05545
21.04531632
-
N-Ethylmaleimide
N-Ethylmaleimide
ME283738
-
C02441
12.13081884
-
Neuraminic acid
Neuraminic acid
ME283876
-
C06469
16.66943187
-
N-Glycolyl-D-mannosamine
Glycolyl-D-mannosamine
ME283675
-
C03521
15.65445792
-
N-hydroxyvaline
N-Hydroxy-valine
ME284006
-
-
8.552763707
-
Nicotinamide
Niacinamide
ME283984
-
C00153
7.481652585
-
Nicotinamide D-ribonucleotide
Nicotinamide ribotide
ME283713
-
C00455
15.0569121
-
Nicotinate D-ribonucleoside
D-Ribosylnicotinate
ME283799
-
C05841
12.41150589
-
N-(L-Arginino)succinate
Argininosuccinic acid
ME283855
-
C03406
16.5873319
-
N-Ribosylhistidine
N-Ribosylhistidine
ME283774
-
-
15.20138894
-
N-stearoyl tyrosine
N-Stearoyl tyrosine
ME283695
-
-
4.599403907
-
N-Sulfo-D-glucosamine
N-Sulfo-glucosamine
ME283682
-
C01075
16.93362123
-
O-Acetylcarnitine
CAR 2:0
ME283746
-
C02571
10.96865868
-
O-Acetyl-L-homoserine
O-Acetyl-homoserine
ME283935
-
C01077
11.09187177
-
O-Butanoylcarnitine
CAR 4:0
ME283850
-
C02862
8.891983267
-
Oleoylcarnitine
CAR 18:1
ME283960
-
-
4.63468099
-
O-Palmitoyl-R-carnitine
CAR 16:0
ME283809
-
C02990
4.690465187
-
Ophthalmicacid
Ophthalmic acid
ME283770
-
-
13.19223747
-
O-Propanoylcarnitine
CAR 3:0
ME283928
-
C03017
9.804307838
-
Otonecine
Otonecine
ME283859
-
C10356
11.15884649
-
Ovothiol A-cysteine disulfide
-
ME283996
-
-
15.12273016
-
Pantothenate
Pantothenic acid
ME283661
-
C00864
8.550945707
-
PC(14:1)
PC 14:1
ME283877
-
-
4.931889913
-
[PC(18:3)]
-
ME283886
-
-
4.864468908
-
PC(32:0)
PC 32:0
ME283638
-
-
4.183117233
-
PC(34:1)
PC 34:1
ME283779
-
-
4.144634782
-
PC(34:2)
PC 34:2
ME283868
-
-
4.142700325
-
PC(36:4)
PC 36:4
ME283904
-
-
4.115261088
-
PC(38:4)
PC 38:4
ME283821
-
-
4.070003638
-
PC(38:6)
PC 38:6
ME283927
-
-
4.08407289
-
PC(40:6)
PC 40:6
ME283795
-
-
4.043855173
-
PE(32:0)
PE 32:0
ME283653
-
-
3.782723947
-
PE(32:1)
PE 32:1
ME283720
-
-
3.781461843
-
PE(36:5)
PE 36:5
ME283962
-
-
4.031453
-
[PE(O-18:2)] 1-octadecyl-sn-glycero-3-phosphoethan...
-
ME283651
-
-
5.00487495
-
PE(O-38:5)
PE O-38:5
ME283740
-
C00350
3.975460432
-
PE(P-20:0)
PE P-20:0
ME283871
-
-
4.742727078
-
PE(P-34:1)
PE P-34:1
ME283748
-
C00350
4.031906798
-
PE(P-36:2)
PE P-36:2
ME283881
-
C00350
4.065292567
-
PE(P-36:4)
PE P-36:4
ME283872
-
C00350
4.000615052
-
PE(P-38:5)
PE P-38:5
ME283893
-
C00350
3.98053552
-
PE(P-40:4)
PE P-40:4
ME283786
-
-
3.946992928
-
PE(P-40:5)
PE P-40:5
ME283762
-
-
3.962108418
-
Phenylacetonitrile
Benzeneacetonitrile
ME283994
-
C16074
8.896340355
-
Phosphocreatine
Phosphocreatine
ME283671
-
C02305
14.98419007
-
Phosphoenolpyruvate
Phosphoenolpyruvic acid
ME283991
-
C00074
17.78436562
-
Phytuberin
Phytuberin
ME283918
-
C09709
4.271265803
-
[PI(36:0)
PI 36:0
ME283678
-
-
3.825080743
-
Picolinamide
Picolinamide
ME283664
-
C01950
13.91490302
-
Piperidine
Piperidine
ME283637
-
C01746
14.53513123
-
[PR] Farnesyl pyrophosphate
Farnesyl diphosphate
ME283937
-
C00448
10.69558166
-
Procollagen 5-(D-galactosyloxy)-L-lysine
Galactosylhydroxylysine
ME283701
-
C05547
16.49422466
-
protocatechualdehyde
-
ME283732
-
C16700
15.97852519
-
PS(34:0)
PS 34:0
ME283705
-
-
3.81518046
-
PS(42:10)
PS 42:10
ME283891
-
-
3.75469837
-
Pseudoecgonine
Pseudoecgonine
ME283775
-
C12449
11.82936125
-
psicoselysine
Psicosyllysine
ME283827
-
-
20.8644715
-
Pyridoxine
Pyridoxine
ME283912
-
C00314
8.116175792
-
Pyrimidine nucleoside
Pyrimidine nucleoside
ME284001
-
C03169
7.762589798
-
quinolin-2(1H)-one
2-Hydroxyquinoline
ME283980
-
C06338
8.72919113
-
Quinoline
Quinoline
ME283672
-
C06413
11.44149674
-
Retronecine
Retronecine
ME283744
-
C06177
13.42361755
-
Ribitol
Ribitol
ME283703
-
C00474
12.83398273
-
(R)-S-Lactoylglutathione
S-Lactoylglutathione
ME283974
-
C03451
13.1059762
-
(S)-2-Aceto-2-hydroxybutanoate
Acetohydroxybutyric acid
ME283698
-
C06006
10.98300599
-
Sanguinarine
Sanguinarine
ME283634
-
C06162
13.15651211
-
(S)-ATPA
(S)-ATPA
ME284005
-
C13733
7.46094377
-
Ser-Ser-His
Ser-Ser-His
ME283741
-
-
17.58361953
-
Slaframine
Slaframine
ME283742
-
C06185
10.08527684
-
SM(d32:1)
SM 32:1;O2
ME283681
-
-
4.428534803
-
SM(d33:1)
SM 33:1;O2
ME283725
-
-
4.412977168
-
SM(d34:1)
SM 34:1;O2
ME283666
-
-
4.403213782
-
SM(d34:2)
SM 34:2;O2
ME283784
-
-
4.389533103
-
SM(d35:1)
SM 35:1;O2
ME283648
-
-
4.396958785
-
SM(d36:1)
SM 36:1;O2
ME283663
-
C00550
4.3913157
-
SM(d36:2)
SM 36:2;O2
ME283778
-
-
4.368523705
-
SM(d38:2)
SM 38:2;O2
ME283817
-
-
4.355698607
-
SM(d40:2)
SM 40:2;O2
ME283680
-
-
4.364606247
-
SM(d42:3)
SM 42:3;O2
ME283721
-
-
4.332834073
-
sn-glycero-3-Phosphocholine
sn-Glycero-3-phosphocholine
ME283866
-
C00670
14.34400117
-
[SP (24:0)] N-(15Z-tetracosenoyl)-sphing-4-enine
Cer 18:1;O2/24:1
ME283885
-
C00195
3.945635035
-
Sphinganine
Sphinganine
ME283749
-
C00836
7.447991355
-
[SP] Sphing-4-enine
Sphingosine
ME283636
-
C00319
4.369922993
-
[ST] (5Z,7E)-9,10-seco-5,7,10(19)-cholestatriene
3-Deoxyvitamin D3
ME283650
-
-
3.807539732
-
Stearoylcarnitine
CAR 18:0
ME283769
-
-
4.52759224
-
Succinyladenosine
Succinyladenosine
ME283667
-
-
14.31036851
-
Temurin
Temurin
ME283976
-
-
9.666807157
-
Tetradecanoylcarnitine
CAR 14:0
ME283954
-
-
4.900427587
-
Thiamin
Thiamine
ME283899
-
C00378
20.69144725
-
Thiamin diphosphate
Thiamine diphosphate
ME283853
-
C00068
14.47037199
-
Thr-Ala-Ala
Thr-Ala-Ala
ME283909
-
-
16.38910405
-
Thr-Ala-Pro
Thr-Ala-Pro
ME283985
-
-
15.15450289
-
Thr-Pro
Thr-Pro
ME283949
-
-
11.49480414
-
trans-Hexadec-2-enoylcarnitine
CAR 16:1(2E)
ME283865
-
-
4.794638958
-
Trp-Asn
Trp-Asn
ME283989
-
-
9.873717092
-
Trp-Cys-Gly
Trp-Cys-Gly
ME283988
-
-
9.203756688
-
Tussilagine
Tussilagine
ME283837
-
C10411
10.42411112
-
Umbelliferone
Umbelliferone
ME284002
-
C09315
5.107707595
-
Urocanate
Urocanic acid
ME283906
-
C00785
10.27896188
-
Vinylacetylglycine
Vinylacetylglycine
ME283981
-
-
9.406335093
-
ZAPA
ZAPA
ME283630
-
C13695
13.54606137
-
Analysis: pHILIC NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
1,3-alpha-D-Mannosyl-(1,2-N-acetyl-alpha-D-glucosa...
-
ME284133
-
C04923
17.18941287
-
1,4-Lactone
gamma-Butyrolactone
ME284239
-
C01770
14.02335372
-
1-(5'-Phosphoribosyl)-5-amino-4-imidazolecarboxami...
AICAR
ME284089
-
C04677
14.92188208
-
2,2-Dimethyl-3-[4-(acetyloxy)phenyl]-4-ethyl-2H-1-...
-
ME284220
-
C15050
8.131305402
-
2,3,4,5-Tetrahydrodipicolinate
-
ME284125
-
C03972
7.44554119
-
2,7-Anhydro-alpha-N-acetylneuraminic acid
N-Acetyl-2,7-anhydro-alpha-neuraminic acid
ME284084
-
C04521
12.97200233
-
2(alpha-D-Mannosyl)-D-glycerate
2-(alpha-D-mannosyl)-D-glyceric acid
ME284123
-
C11544
14.67799764
-
2-amino-2-deoxy-isochorismate
-
ME284120
-
-
11.69973171
-
2-Amino-9,10-epoxy-8-oxodecanoic acid
2-Amino-9,10-epoxy-8-oxodecanoic acid
ME284301
-
C12027
12.77329168
-
2-Benzothiazolesulfonamide
-
ME284335
-
C14181
10.04774858
-
2-Carboxy-D-arabinitol 1-phosphate
2-Carboxy-D-arabinitol 1-phosphate
ME284197
-
C04234
16.89933252
-
2-C-Methyl-D-erythritol 4-phosphate
-
ME284223
-
C11434
13.12233196
-
2-Deoxy-2,3-dehydro-N-acetylneuraminic acid
2-Deoxy-2,3-dehydro-N-acetylneuraminic acid
ME284094
-
C04580
12.29790994
-
2-deoxyglucose-6-phosphate
2-Deoxy-D-glucose 6-phosphate
ME284026
-
-
13.35684977
-
2-Hydroxyethanesulfonate
2-Hydroxyethanesulfonate
ME284067
-
C05123
10.56552256
-
2-(Hydroxymethyl)-3-(acetamidomethylene)succinate
-
ME284158
-
C04690
19.92321125
-
2-O-alpha-L-Rhamnopyranosyl-D-glucopyranose
Neohesperidose
ME284177
-
C08244
15.86976842
-
2-Oxoglutarate
2-Oxoglutaric acid
ME284105
-
C00026
15.32673363
-
2-Phospho-D-glycerate
2-Phosphoglyceric acid
ME284332
-
C00631
17.83870747
-
(2R,4S)-2,4-Diaminopentanoate
-
ME284292
-
C03943
15.74624826
-
3-(4-Hydroxyphenyl)lactate
Hydroxyphenyllactic acid
ME284041
-
C03672
8.697232238
-
3-(ADP)-glycerate
-
ME284264
-
C02509
16.35476557
-
3-beta-D-Galactosyl-sn-glycerol
Galactosylglycerol
ME284147
-
C05401
13.62381745
-
3-Dehydroquinate
3-Dehydroquinate
ME284245
-
C00944
10.71027055
-
3-Deoxy-D-manno-octulosonate 8-phosphate
-
ME284318
-
C04478
15.0445159
-
3-O-(6'-O-(13Z,16Z,19Z-docosatrienoyl)-beta-D-gluc...
-
ME284038
-
-
4.946490252
-
3-Phospho-D-glycerate
3-Phosphoglyceric acid
ME284247
-
C00197
16.73710893
-
3-Phospho-D-glyceroyl phosphate
3-Phospho-D-glyceroyl dihydrogen phosphate
ME284328
-
C00236
17.88566087
-
3-phosphoglucarate
-
ME284296
-
-
18.9969255
-
3-Phosphonopyruvate
-
ME284092
-
C02798
12.61414698
-
(3S,5S)-carbapenam
-
ME284199
-
-
11.58082909
-
3-ureidoacrylate
-
ME284184
-
-
12.03369044
-
4-Amino-4-deoxychorismate
4-Amino-4-deoxychorismic acid
ME284048
-
C11355
13.07539492
-
4-Nitroaniline
4-Nitroaniline
ME284230
-
C02126
13.42985056
-
5D-5-O-Methyl-2,3,5/4,6-pentahydroxycyclohexanone
-
ME284135
-
C01295
13.71859844
-
5'-Dehydroadenosine
5'-Dehydroadenosine
ME284310
-
C11500
10.14032708
-
5-Hydroxytryptophan
5-Hydroxy-tryptophan
ME284314
-
C01017
9.956378975
-
5-Oxoproline
Pyroglutamic acid
ME284076
-
C01879
10.09709493
-
5-Valerolactone
5-Valerolactone
ME284246
-
C02240
4.698571545
-
6-Methylpretetramide
6-Methylpretetramide
ME284215
-
C06629
11.3744225
-
[6]-Paradol
1-(4-Hydroxy-3-methoxyphenyl)-3-decanone
ME284306
-
C10482
3.974910377
-
6-Phospho-D-gluconate
6-Phosphogluconic acid
ME284235
-
C00345
17.49184057
-
A-Ketoglutaricacidoxime
alpha-Ketoglutaric acid oxime
ME284116
-
-
8.005629995
-
Ala-Ala-Asp-Tyr
-
ME284213
-
-
11.23860778
-
Ala-Asp
Ala-Asp
ME284210
-
-
15.90786231
-
Ala-Asp-Gly
Ala-Asp-Gly
ME284330
-
-
17.06061577
-
Ala-Cys-Pro-Ser
-
ME284248
-
-
14.56997431
-
Ala-Gly-Ser
Ala-Gly-Ser
ME284269
-
-
12.79106831
-
Ala-Lys-Ala-Ala
-
ME284285
-
-
13.83733447
-
Ala-Phe-Tyr-Tyr
-
ME284311
-
-
14.51693887
-
Ala-Thr-Ala-Gly
-
ME284161
-
-
17.69715072
-
alpha-Irone
alpha-Irone
ME284097
-
C09690
4.180762238
-
AMP
AMP
ME284286
-
C00020
14.86589865
-
Apodine
Apodine
ME284227
-
C09034
14.62474519
-
Arg-Lys-Asn-Gln
-
ME284174
-
-
23.57913532
-
Arg-Phe-Phe-Arg
-
ME284054
-
-
14.77367702
-
Asn-Asn-Gly-His
-
ME284293
-
-
14.65740272
-
Asn-Cys-Cys
Asn-Cys-Cys
ME284302
-
-
14.41457858
-
Asn-Leu-Lys-Trp
-
ME284073
-
-
23.56846358
-
Asn-Met-Thr-Asp
-
ME284078
-
-
10.8458385
-
Aspartyl-L-proline
Asp-Pro
ME284179
-
-
15.24746685
-
Asp-Gly
Asp-Gly
ME284255
-
-
16.13859641
-
Asp-Gly-Pro-Ser
-
ME284170
-
-
13.78798462
-
Asp-Val-Pro-Ser
-
ME284233
-
-
9.962649855
-
ATP
ATP
ME284252
-
C00002
16.17172946
-
Bergaptol
Bergaptol
ME284121
-
C00758
14.93770106
-
beta-(2,6-anhydro-3-deoxy-D-arabino-heptulopyranos...
-
ME284119
-
-
21.81049913
-
beta-D-Fructose 2,6-bisphosphate
Fructose 2,6-bisphosphate
ME284299
-
C00665
15.35010119
-
beta-D-Sedoheptulopyranose
beta-D-sedoheptulose
ME284044
-
C08355
11.82323148
-
Bile salt
-
ME284028
-
C01558
5.14924184
-
Bis-D-fructose 2',1:2,1'-dianhydride
Bis-D-fructose 2',1:2,1'-dianhydride
ME284196
-
C04333
14.55958584
-
Camptothecin
Camptothecin
ME284061
-
C01897
12.93151434
-
Carbamoyl phosphate
Carbamoylphosphate
ME284015
-
C00169
27.98989008
-
CDP-ethanolamine
CDP-Ethanolamine
ME284141
-
C00570
16.10637604
-
Chelilutine
Chelilutine
ME284291
-
C12229
11.38866374
-
Chenodeoxyglycocholate
Glycochenodeoxycholic acid
ME284212
-
C05462
4.87592309
-
Chitobiose
N,N'-Diacetylchitobiose
ME284058
-
C01674
19.96909392
-
Chloraminophenamide
Chloraminophenamide
ME284192
-
C07460
7.47729609
-
Cholesterolsulfate
Cholesterol sulfate
ME284178
-
-
3.70556605
-
Cichorine
Cichorine
ME284022
-
C10581
5.034283325
-
cis-Aconitate
cis-Aconitic acid
ME284194
-
C00417
17.66769568
-
Citrate
Citric acid
ME284173
-
C00158
17.90929255
-
Clavulanic acid
Clavulanate
ME284085
-
C06662
7.3933763
-
CMP-2-aminoethylphosphonate
CMPciliatine
ME284117
-
C05673
15.08972262
-
CMP-N-trimethyl-2-aminoethylphosphonate
CMP-2-trimethylaminoethylphosphonate
ME284046
-
C05674
14.20959566
-
CoA
Coenzyme A
ME284289
-
C00010
5.16044196
-
Cyclic ADP-ribose
Cyclic ADP-ribose
ME284063
-
C13050
13.95535082
-
Cys-Gly-Pro-Ser
-
ME284242
-
-
14.70856296
-
Cys-Leu-Cys-Tyr
-
ME284087
-
-
10.28113645
-
Cys-Phe-Gly-Gly
-
ME284308
-
-
10.70086643
-
D-4'-Phosphopantothenate
(R)-4'-Phosphopantothenic acid
ME284201
-
C03492
14.93707203
-
D-Arabinonate
Arabinonic acid
ME284206
-
C00878
13.32930145
-
deacetylcolchicine
-
ME284151
-
C16712
14.90935317
-
D-Erythrose
Erythrose
ME284103
-
C01796
14.51295821
-
D-Fructose
Fructose
ME284180
-
C00095
16.86031303
-
D-Fructose 1,6-bisphosphate
Fructose 1,6-bisphosphate
ME284251
-
C00354
17.80341417
-
D-Galacturonate
Galacturonic acid
ME284033
-
C00333
14.29160642
-
dGDP
dGDP
ME284278
-
C00361
16.17385192
-
D-Glucarate
Glucaric acid
ME284186
-
C00818
16.82854692
-
D-Gluconic acid
Gluconic acid
ME284130
-
C00257
13.32726317
-
D-Glucono-1,5-lactone
Gluconolactone
ME284159
-
C00198
11.92076408
-
D-Glucose
Glucose
ME284169
-
C00221
12.73122539
-
D-Glucose 1-phosphate
Glucose 1-phosphate
ME284226
-
C00103
15.06431526
-
D-Glucose 6-phosphate
Glucose 6-phosphate
ME284132
-
C00092
16.55032596
-
D-Glucuronate
Glucuronic acid
ME284036
-
C00191
15.51171748
-
D-Glycerate
Glyceric acid
ME284137
-
C00258
11.67713123
-
Diethyl (2R,3R)-2-methyl-3-hydroxysuccinate
-
ME284017
-
C04586
6.968052637
-
DL-2-Aminooctanoicacid
2-Aminocaprylic acid
ME284152
-
-
11.00025704
-
D-Mannitol 1-phosphate
Mannitol 1-phosphate
ME284083
-
C00644
14.99406217
-
D-Mannose
Mannose
ME284039
-
C00159
14.70132011
-
D-Mannose 1-phosphate
Mannose 1-phosphate
ME284265
-
C00636
17.75805505
-
D-Mannose 6-phosphate
Mannose 6-phosphate
ME284300
-
C00275
15.74963867
-
D-myo-Inositol 1,2-cyclic phosphate
Inositol cyclic phosphate
ME284127
-
C04299
17.2896056
-
Docosanoic acid
Behenic acid
ME284080
-
C08281
3.809999103
-
D-Ribose
Ribose
ME284138
-
C00121
11.7878832
-
D-Ribose 1,5-bisphosphate
Ribose 1,5-bisphosphate
ME284309
-
C01151
17.55992453
-
D-Ribose 5-phosphate
Ribose 5-phosphate
ME284191
-
C00117
15.39532037
-
D-Sedoheptulose 1,7-bisphosphate
Sedoheptulose 1,7-bisphosphate
ME284283
-
C00447
18.08788318
-
D-Sedoheptulose 7-phosphate
D-Sedoheptulose 7-phosphate
ME284238
-
C05382
15.94682843
-
dTTP
dTTP
ME284321
-
C00459
15.7572902
-
D-Xylose
Xylose
ME284091
-
C00181
14.1500963
-
Erythronicacid
Erythronic acid
ME284112
-
-
16.22982429
-
[FA (16:4)] hexadecatetraenoic acid
Hexadecatetraenoic acid
ME284280
-
-
4.1711462
-
FA (17:0)
Margaric acid
ME284241
-
-
3.885237338
-
[FA (18:1)] 9Z-octadecenoic acid
Oleic acid
ME284307
-
C00712
3.874698003
-
[FA (18:3)] 9Z,12Z,15Z-octadecatrienoic acid
alpha-Linolenic acid
ME284327
-
C06427
3.892185708
-
FA (20:0)
Arachidic acid
ME284260
-
C06425
3.82997776
-
[FA (20:1)] 11Z-eicosenoic acid
cis-Gondoic acid
ME284333
-
C16526
3.84177318
-
FA (20:4)
Arachidonic acid
ME284315
-
C00219
3.888428517
-
[FA (22:5)] 7Z,10Z,13Z,16Z,19Z-docosapentaenoic ac...
DPA
ME284287
-
C16513
3.84303657
-
[FA (23:0)] tricosanoic acid
Tricosylic acid
ME284243
-
-
3.80511942
-
Fagomine
Fagomine
ME284187
-
C10144
13.08241119
-
[FA hydroxy(18:0)] 9-hydroperoxy-12,13-dihydroxy-1...
-
ME284221
-
-
4.346843572
-
FA methyl(16:1)
-
ME284316
-
-
3.922234342
-
FA methyl(18:0)
-
ME284229
-
-
3.849920365
-
[FA] Methyl jasmonate
Methyl jasmonate
ME284207
-
C11512
4.327844852
-
[FA oxo(8:1)] 5-oxo-7-octenoic acid
5-Oxo-7-octenoic acid
ME284294
-
-
4.661611087
-
[FA trihydroxy(4:0)] 2,3,4-trihydroxy-butanoic aci...
Threonic acid
ME284100
-
C01620
12.35296572
-
Folate
Folic acid
ME284144
-
C00504
16.47840145
-
GalNAcbeta1-3Galalpha1-4Galbeta1-4Glcbeta-Cer(d18:...
-
ME284057
-
-
5.151543788
-
Ganglioside GA1 (d18:1/24:1(15Z))
-
ME284050
-
C06136
7.44663039
-
Ganglioside GM1 (d18:1/24:1(15Z))
-
ME284027
-
C04911
5.149195083
-
GDP-L-fucose
GDP-L-fucose
ME284164
-
C00325
17.33665688
-
GDP-mannose
GDP-mannose
ME284113
-
C00096
17.97393138
-
Glepidotin B
Glepidotin B
ME284329
-
C09753
10.08179068
-
Glucosylgalactosylhydroxylysine
Glucosylgalactosyl hydroxylysine
ME284188
-
-
21.73118185
-
Glu-Cys
Glu-Cys
ME284029
-
-
11.15057411
-
Glu-Glu
Glu-Glu
ME284035
-
C01425
13.79393348
-
Glu-Gly
Glu-Gly
ME284275
-
-
14.66318207
-
Glutathione
Glutathione
ME284136
-
C00051
14.0340979
-
glutathione-sulfite
-
ME284075
-
-
18.86747252
-
Glycerone phosphate
Dihydroxyacetone phosphate
ME284320
-
C00111
15.13806999
-
Glycylproline
Gly-Pro
ME284056
-
-
14.05823656
-
Glyoxylate
Glyoxylic acid
ME284182
-
C00048
16.78378723
-
H2S2O3
-
ME284305
-
C05529
21.27569312
-
HEPES
-
ME284077
-
-
10.41563797
-
Heptopyranosides
-
ME284290
-
C02413
5.145871247
-
Hexadecanoic acid
Palmitic acid
ME284312
-
C00249
3.905914953
-
hexane-6-ol-1,3,4,6-tetracarboxylate
-
ME284167
-
-
22.55102857
-
Hydantoin-5-propionate
Hydantoin-5-propionic acid
ME284222
-
C05565
15.21922807
-
Hydroxymethylphosphonate
Hydroxymethylphosphonic acid
ME284072
-
C06455
14.29010709
-
Hydroxypyruvate
Hydroxypyruvic acid
ME284231
-
C00168
14.83192997
-
Icosatrienoic acid
ETrE(11Z,14Z,17Z)
ME284304
-
C16522
3.864977377
-
IDP-D-mannose
-
ME284016
-
-
16.6570161
-
Imidazole-4-acetaldehyde
Imidazole-4-acetaldehyde
ME284040
-
C05130
12.19964437
-
Iminodiacetate
Iminodiacetate
ME284081
-
-
16.33059127
-
IMP
IMP
ME284114
-
C00130
15.22675294
-
Indoleacrylicacid
Indoleacrylic acid
ME284274
-
-
8.74319863
-
Indoxylsulfate
Indoxyl sulfate
ME284053
-
-
7.44922687
-
ITP
ITP
ME284018
-
C00081
17.69839265
-
Kinobscurinone
Kinobscurinone
ME284326
-
C12391
12.18463427
-
L-Arabinose
Lyxose
ME284297
-
C00259
12.25922332
-
L-Aspartate
Aspartic acid
ME284168
-
C00049
14.74046682
-
L-cysteine sulfinate
-
ME284070
-
-
14.25282405
-
L-Erythrulose
Erythrulose
ME284228
-
C02045
10.47957644
-
L-Fuculose 1-phosphate
L-Fuculose 1-phosphate
ME284122
-
C01099
15.22796767
-
LPA(18:0)
LPA 18:0
ME284166
-
C00416
4.74111732
-
LysoPE(22:4)
LPE 22:4
ME284323
-
-
4.54384125
-
LysoPE(22:5)
LPE 22:5
ME284322
-
-
4.566842613
-
Mannitol
Mannitol
ME284216
-
C00392
13.83016567
-
melibionate
-
ME284205
-
-
14.96793184
-
(-)-Menthyl O-beta-D-glucoside
Menthyl beta-D-glucoside
ME284124
-
C03962
4.718137977
-
MES
Dimethyl sulfone
ME284079
-
-
7.666167413
-
Met-Met-Met
Met-Met-Met
ME284066
-
-
13.93361914
-
Miroestrol
-
ME284115
-
C08831
14.42385984
-
Monomethyl sulfate
Methyl sulfate
ME284224
-
C02704
12.74981397
-
N-(2,3-Dihydroxybenzoyl)-L-serine
N-(2,3-Dihydroxybenzoyl)-L-serine
ME284214
-
C04204
19.91593015
-
N3-fumaramoyl-L-2,3-diaminopropanoate
-
ME284095
-
-
15.41620516
-
N5-formyl-N5-hydroxy-L-ornithine
-
ME284163
-
-
11.71378746
-
N-Acetylanthranilate
Methyl n-acetylanthranilate
ME284043
-
C06332
8.129465438
-
N-Acetyl-beta-D-glucosaminylamine
N-Acetyl-beta-glucosaminylamine
ME284102
-
C01239
13.01659201
-
N-Acetyl-D-fucosamine
N-Acetyl-D-fucosamine
ME284021
-
C15480
10.79535591
-
N-Acetyl-D-glucosaminate
N-acetyl-glucosaminic acid
ME284126
-
C01133
12.25680125
-
N-Acetyl-D-glucosamine 1,6-bisphosphate
N-Acetylglucosamine 1,6-bisphosphate
ME284271
-
C04461
16.75016667
-
N-Acetyl-D-glucosamine 6-phosphate
N-Acetyl-glucosamine 6-phosphate
ME284093
-
C00357
14.60185419
-
N-Acetyl-L-glutamate
N-Acetylglutamic acid
ME284211
-
C00624
13.85261124
-
N-Acetylneuraminate
N-Acetylneuraminic acid
ME284031
-
C00270
13.09432213
-
N-Acetylornithine
N-Acetylornithine
ME284236
-
C00437
13.40065223
-
N-Benzyloxycarbonylglycine
N-Benzyloxycarbonylglycine
ME284237
-
C03710
5.175446605
-
N-Glycolyl-D-glucosamine
N-Glycolyl-D-glucosamine
ME284202
-
C03146
12.87127822
-
N-Heptanoylhomoserine lactone
N-Heptanoyl-homoserine lactone
ME284319
-
C11844
4.439393708
-
N-Hydroxy-L-tyrosine
N-Hydroxy-tyrosine
ME284155
-
C03004
10.24188675
-
nicotinamide guanine dinucleotide
-
ME284064
-
-
12.98724267
-
NicotinamideN-oxide
Nicotinamide N-oxide
ME284030
-
-
12.46962116
-
N,N-Dihydroxy-L-tyrosine
N,N-Dihydroxy-tyrosine
ME284109
-
C15503
12.72444334
-
N,N-Dimethylglycine
Dimethylglycine
ME284193
-
C01026
14.34353133
-
N,N'-Dimethylurea
N,N-Dimethylurea
ME284148
-
C16364
14.12854095
-
nonulose 9-phosphate
Nonulose 9-phosphate
ME284190
-
-
16.57862806
-
Norepinephrinesulfate
Norepinephrine sulfate
ME284324
-
-
18.71994443
-
N-Succinyl-L-glutamate
N2-Succinylglutamate
ME284096
-
C05931
13.89374544
-
N-(tetradecanoyl)-sphing-4-enine-1-phosphate
CerP 18:1;O2/14:0
ME284025
-
-
4.431296153
-
Octadecanoic acid
Stearic acid
ME284303
-
C01530
3.862901218
-
octulose 8-phosphate
Octulose 8-phosphate
ME284276
-
-
16.2716193
-
Orotate
Orotic acid
ME284042
-
C00295
9.97408237
-
Orotate(Fragment)
Orotic acid
ME284200
-
C00295
15.09033351
-
Orotidine
Orotidine
ME284149
-
-
12.12407994
-
Orthophosphate
Phosphoric acid
ME284288
-
C00009
15.69410245
-
O-Succinyl-L-homoserine
o-Succinylhomoserine
ME284156
-
C01118
13.66101056
-
Ovothiol disulfide
-
ME284217
-
-
15.64774519
-
oxindole-3-acetyl-aspartate-N-beta-glucosyl-beta-1...
-
ME284181
-
-
14.70630697
-
[PA(16:0/0:0)] 1-hexadecanoyl-2-sn-glycero-3-phosp...
LPA 16:0
ME284254
-
C00416
4.864468897
-
PA(34:1)
PA 34:1
ME284069
-
-
3.79446877
-
PA(34:2)
PA 34:2
ME284086
-
-
3.788600332
-
PA(36:1)
PA 36:1
ME284107
-
-
3.787456027
-
PA(36:2)
PA 36:2
ME284203
-
C00416
3.779314283
-
PA(36:3)
PA 36:3
ME284232
-
-
3.778578103
-
PA(36:4)
PA 36:4
ME284195
-
-
3.765539627
-
P-DPD
-
ME284052
-
-
12.46297669
-
PE(12:0/18:4(6Z,9Z,12Z,15Z))
PE 12:0/18:4(6Z,9Z,12Z,15Z)*
ME284019
-
-
5.158847128
-
PE(13:0/18:4(6Z,9Z,12Z,15Z))
PE 13:0/18:4(6Z,9Z,12Z,15Z)*
ME284060
-
-
5.170686725
-
PE(18:1)
PE 18:1
ME284313
-
-
4.751963065
-
PE(30:4)
PE 30:4
ME284032
-
-
7.45474892
-
PE(31:4)
PE 31:4
ME284047
-
-
7.447051315
-
PE(34:1)
PE 34:1
ME284204
-
-
4.024408617
-
PE(34:2)
PE 34:2
ME284263
-
-
4.030236153
-
PE(34:3)
PE 34:3
ME284068
-
-
4.03632002
-
PE(36:1)
PE 36:1
ME284165
-
-
4.001002332
-
PE(36:2)
PE 36:2
ME284295
-
C00350
4.00168334
-
PE(36:3)
PE 36:3
ME284268
-
-
4.003970813
-
PE(36:4)
PE 36:4
ME284256
-
-
4.002105402
-
PE(38:4)
PE 38:4
ME284259
-
C00350
3.981934055
-
PE(38:5)
PE 38:5
ME284284
-
-
3.985416748
-
PE(38:6)
PE 38:6
ME284298
-
-
3.981317548
-
PE(40:5)
PE 40:5
ME284277
-
-
3.974312335
-
Perseitol
Perseitol
ME284234
-
C08255
14.52690341
-
[PG (18:0)] 1-octadecanoyl-sn-glycero-3-phospho-(1...
-
ME284045
-
-
3.902362585
-
PG(18:4(6Z,9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)...
PG 18:4(6Z,9Z,12Z,15Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)*
ME284253
-
-
7.449407822
-
PG(34:1)
PG 34:1
ME284051
-
-
3.823273863
-
PG(36:1)
PG 36:1
ME284074
-
-
3.827444682
-
PG(36:2)
PG 36:2
ME284099
-
-
3.807142557
-
PG(36:3)
PG 36:3
ME284106
-
-
3.681036555
-
PG(36:5)
PG 36:5
ME284143
-
-
3.690732122
-
PG(40:5)
PG 40:5
ME284020
-
-
3.690328682
-
phe-FMDP
-
ME284189
-
-
11.63922397
-
Phenolsulfonphthalein
Phenolsulfonphthalein
ME284218
-
C12600
5.186870783
-
Phenylpropanoate
Hydrocinnamic acid
ME284014
-
C05629
4.86483499
-
Phosphodimethylethanolamine
N,N-Dimethylethanolamine phosphate
ME284244
-
C13482
14.87883895
-
Phosphonoacetaldehyde
Phosphonoacetaldehyde
ME284104
-
C03167
14.78303807
-
[PI(18:0)] 1-octadecanoyl-sn-glycero-3-phospho-(1'...
-
ME284062
-
-
4.33292547
-
PI(32:1)
PI 32:1
ME284249
-
-
3.809068923
-
PI(36:1)
PI 36:1
ME284134
-
-
3.82577958
-
PI(36:2)
PI 36:2
ME284098
-
-
3.820549593
-
PI(36:4)
PI 36:4
ME284154
-
-
3.816614137
-
PI(38:4)
PI 38:4
ME284140
-
-
3.807760627
-
PI(38:5)
PI 38:5
ME284088
-
-
3.808399913
-
PIP(38:4)
PI P-38:4
ME284261
-
C00626
7.451777045
-
PIPES
-
ME284176
-
-
14.16869839
-
Proclavaminic acid
Proclavaminic acid
ME284334
-
C06658
9.802543857
-
Pro-His
Pro-His
ME284317
-
-
12.12252574
-
PS(18:0)
PS 18:0
ME284037
-
-
4.272575785
-
PS(34:1)
PS 34:1
ME284157
-
-
3.824420728
-
PS(36:1)
PS 36:1
ME284131
-
-
3.815494363
-
PS(36:2)
PS 36:2
ME284162
-
-
3.811701207
-
PS(36:3)
PS 36:3
ME284257
-
-
3.815643107
-
PS(36:4)
PS 36:4
ME284272
-
-
3.808850488
-
PS(38:4)
PS 38:4
ME284111
-
-
3.79327941
-
PS(38:5)
PS 38:5
ME284209
-
-
3.795047752
-
PS(38:6)
PS 38:6
ME284129
-
-
3.797062695
-
PS(39:4)
PS 39:4
ME284172
-
-
3.78449951
-
PS(40:5)
PS 40:5
ME284128
-
-
3.78326659
-
PS(40:8)
PS 40:8
ME284258
-
-
3.783524968
-
Psychosine
Psychosine
ME284281
-
C01747
4.76048029
-
Pyridoxine phosphate
Pyridoxine 5'-phosphate
ME284110
-
C00627
13.57797923
-
Pyruvate
Pyruvic acid
ME284208
-
C00022
14.52487746
-
Quinate
Quinic acid
ME284090
-
C00296
12.50795416
-
(R)-2-Hydroxyglutarate
2-Hydroxyglutaric acid
ME284059
-
C01087
14.90005236
-
(R)-3-((R)-3-Hydroxybutanoyloxy)butanoate
-
ME284267
-
C04546
12.83910286
-
(R,R)-Tartaric acid
Tartaric acid
ME284273
-
C00898
17.0467003
-
(S)-1-Pyrroline-5-carboxylate
1-Pyrroline-5-carboxylic acid
ME284065
-
C03912
14.65366395
-
(S)-2-Amino-3-(3-hydroxy-4-oxo-4H-pyridin-1-yl)pro...
Mimosine
ME284225
-
C04771
14.12687463
-
S-Adenosyl-L-methionine
S-Adenosylmethionine
ME284082
-
C00019
16.31736959
-
(S)-AMPA
Ampa
ME284055
-
C13672
14.12073387
-
(S)-Carnitine
Carnitine
ME284175
-
C15025
10.98279579
-
(S)-Dihydroorotate
4,5-Dihydroorotic acid
ME284024
-
C00337
10.91162814
-
Sedoheptulose
Glucoheptulose
ME284250
-
C02076
13.70399721
-
Sinalbin
Sinalbin
ME284185
-
C08426
14.45969194
-
(S)-Lactate
Lactic acid
ME284150
-
C00186
9.450691435
-
(S)-Malate
Malic acid
ME284118
-
C00149
15.7884226
-
S-Methyl-5-thio-D-ribose 1-phosphate
5-Methylthioribose 1-phosphate
ME284279
-
C04188
12.81824606
-
sn-glycero-3-Phospho-1-inositol
sn-Glycero-3-phosphoinositol
ME284071
-
C01225
15.86295295
-
sn-glycero-3-Phosphoethanolamine
sn-Glycero-3-phosphoethanolamine
ME284142
-
C01233
15.46748438
-
sn-Glycerol 3-phosphate
sn-Glycero-3-phosphate
ME284198
-
C00093
14.71039716
-
sodium dodecyl sulfate
-
ME284331
-
-
3.733855082
-
[SP (16:0)] N-(hexadecanoyl)-sphing-4-enine
Cer 18:1;O2/16:0
ME284266
-
C00195
3.974066908
-
[SP] Sphing-4-enine-1-phosphate
Sphingosine 1-phosphate
ME284160
-
C06124
5.166987908
-
[SP] Sphinganine-1-phosphate
Sphinganine 1-phosphate
ME284034
-
C01120
5.154204742
-
Stealthin C
Stealthin C
ME284139
-
C12392
15.21083537
-
Succinate semialdehyde
Succinic acid semialdehyde
ME284145
-
C00232
13.42748385
-
Taurine
Taurine
ME284240
-
C00245
14.73873606
-
Tetracosanoic acid
Lignoceric acid
ME284108
-
C08320
3.797675753
-
Thiourocanic acid
Thiourocanic acid
ME284270
-
C05571
14.66141817
-
Thr-Gly
Thr-Gly
ME284262
-
-
13.05573645
-
Trimethylaminoacetone
Trimethylaminoacetone
ME284153
-
-
11.75426967
-
UDP
UDP
ME284219
-
C00015
15.94557772
-
UDP-glucose
UDP-glucose
ME284146
-
C00029
16.11394763
-
UDP-glucuronate
UDP-glucuronic acid
ME284171
-
C00167
18.84965192
-
UDP-N-acetyl-D-galactosamine
UDP-N-acetylgalactosamine
ME284101
-
C00203
14.89195673
-
Urate
Uric acid
ME284023
-
C00366
12.40073381
-
UTP
UTP
ME284282
-
C00075
17.56208705
-
vanillylamine
Vanillylamine
ME284325
-
C16666
7.41068341
-
Vicine
Vicine
ME284049
-
C08437
15.80000794
-
Xylobiose
Xylobiose
ME284183
-
C01630
13.56208763
-
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