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Return to study ST000047 main page
Show: (1)
HMDB and KEGG pathways
(2)
REACTOME pathways
containing these metabolites
Select
Metabolite Name
Metabolite Id
Refmet Name
Ret. Index
Quant. m/z
Analysis Display
2-Methyl-3-ketovalericacid
ME651195
2-Methyl-3-ketovaleric acid
3.7412422
-
MS negative ion mode/C18
2-Methyl-3-ketovalericacid-3.9406526
ME651196
2-Methyl-3-ketovaleric acid
3.9406526
-
MS negative ion mode/C18
2-propyl-tridecanoicacid
ME651197
2-Propyl-tridecanoic acid
14.144142
-
MS negative ion mode/C18
3-Methylpimelicacid
ME651204
3-Methylpimelic acid
5.046156
-
MS negative ion mode/C18
3-Methylsubericacid
ME651205
3-Methylsuberic acid
5.7627726
-
MS negative ion mode/C18
4,8-dimethyl-dodecanoicacid
ME651207
4,8-Dimethyl-dodecanoic acid
13.080509
-
MS negative ion mode/C18
Acetoaceticacid
ME651221
Acetoacetic acid
0.90567994
-
MS negative ion mode/C18
Acetoaceticacid-1.2563984
ME651222
Acetoacetic acid
1.2563984
-
MS negative ion mode/C18
a-hydroxybutyrate
ME651227
2-Hydroxybutyric acid
2.6810246
-
MS negative ion mode/C18
a-hydroxyisovalerate
ME651228
2-Hydroxy-3-methylbutyric acid
3.247896
-
MS negative ion mode/C18
a-hydroxyisovalerate-3.5743096
ME651229
2-Hydroxy-3-methylbutyric acid
3.5743096
-
MS negative ion mode/C18
alpha-hydroxyisobutyrate
ME651231
2-Hydroxyisobutyric acid
2.2812312
-
MS negative ion mode/C18
alpha-hydroxyisobutyrate-1.2596271
ME651232
2-Hydroxyisobutyric acid
1.2596271
-
MS negative ion mode/C18
alpha-hydroxyisobutyrate-2.5388858
ME651233
2-Hydroxyisobutyric acid
2.5388858
-
MS negative ion mode/C18
beta-hydroxybutyrate
ME651253
3-Hydroxybutyric acid
3.4044995
-
MS negative ion mode/C18
Citraconicacid
ME651267
Citraconic acid
1.0285413
-
MS negative ion mode/C18
ethylmalonicacid
ME651298
Ethylmalonic acid
3.2349224
-
MS negative ion mode/C18
Glutaconicacid
ME651303
Glutaconic acid
0.8959234
-
MS negative ion mode/C18
Glutaconicacid-1.257499
ME651304
Glutaconic acid
1.257499
-
MS negative ion mode/C18
Glutaconicacid-1.6951267
ME651305
Glutaconic acid
1.6951267
-
MS negative ion mode/C18
Glutaconicacid-1.7573386
ME651306
Glutaconic acid
1.7573386
-
MS negative ion mode/C18
Glycolicacid
ME651314
Glycolic acid
0.91225773
-
MS negative ion mode/C18
Lauricacid
ME651339
Lauric acid
11.852597
-
MS negative ion mode/C18
Oxaloglutarate
ME651367
2-Oxaloglutaric acid
0.88505715
-
MS negative ion mode/C18
(R)-3-Methyl-2-oxobutanoate
ME651168
Ketoisovaleric acid
3.76955
-
MS negative ion mode/C18
(S)-2-Hydroxyglutarate
ME651169
2-Hydroxyglutaric acid
1.8771077
-
MS negative ion mode/C18
S-Succinyldihydrolipoamide
ME651404
S(8)-Succinyldihydrolipoamide
0.9653422
-
MS negative ion mode/C18
12-oxo-10Z-dodecenoicacid
ME651423
12-Oxo-10Z-dodecenoic acid
1.0445383
-
MS negative ion mode/HILIC
14-pentadecynoicacid
ME651425
14-Pentadecynoic acid
1.050736
-
MS negative ion mode/HILIC
2,3-Dihydroxy-3-methylvalericacid
ME651430
2,3-Dihydroxy-3-methylvaleric acid
1.7424604
-
MS negative ion mode/HILIC
2-Naphthaleneaceticacid,6-hydroxy-
ME651451
2-Octenoic acid
0.8052818
-
MS negative ion mode/HILIC
2-Naphthaleneaceticacid,6-hydroxy--3.1083467
ME651452
2-Octenoic acid
3.1083467
-
MS negative ion mode/HILIC
2-Naphthaleneaceticacid,6-hydroxy--3.220013
ME651453
2-Octenoic acid
3.220013
-
MS negative ion mode/HILIC
2-Oxo-4-methylthiobutanoicacid
ME651454
2-Oxo-4-methylthiobutanoic acid
1.2991978
-
MS negative ion mode/HILIC
2-Propylglutaricacid
ME651455
2-Propylglutaric acid
1.307249
-
MS negative ion mode/HILIC
2-propyl-tridecanoicacid
ME651456
2-Propyl-tridecanoic acid
1.045552
-
MS negative ion mode/HILIC
2-propyl-tridecanoicacid-1.9754443
ME651457
2-Propyl-tridecanoic acid
1.9754443
-
MS negative ion mode/HILIC
3-dodecynoicacid
ME651465
3-Dodecynoic acid
1.0513127
-
MS negative ion mode/HILIC
3E,5E-tridecadienoicacid
ME651466
3E,5E-Tridecadienoic acid
1.1176943
-
MS negative ion mode/HILIC
3-Hydroxydodecanedioicacid
ME651469
3-Hydroxy-dodecanedioic acid
1.0771362
-
MS negative ion mode/HILIC
3-Methylsubericacid
ME651471
3-Methylsuberic acid
1.2524943
-
MS negative ion mode/HILIC
3-oxo-dodecanoicacid
ME651472
3-Oxododecanoic acid
0.90155995
-
MS negative ion mode/HILIC
4,8-dimethyl-dodecanoicacid
ME651473
4,8-Dimethyl-dodecanoic acid
1.9757005
-
MS negative ion mode/HILIC
4-amino-4-cyano-butanoicacid
ME651474
4-Amino-4-cyano-butanoic acid
2.9633734
-
MS negative ion mode/HILIC
4-hydroxypelargonicacid
ME651475
4-Hydroxypelargonic acid
1.16755
-
MS negative ion mode/HILIC
(+)-6-methylcaprylicacid
ME651418
6-Methyloctanoic acid
1.0773249
-
MS negative ion mode/HILIC
7-Hydroxyoctanoicacid
ME651491
7-Hydroxyoctanoic acid
1.1834966
-
MS negative ion mode/HILIC
9-hydroxy-5Z-nonenoicacid
ME651494
9-Hydroxy-5Z-nonenoic acid
1.1193868
-
MS negative ion mode/HILIC
9-lauroleicacid
ME651495
9-Dodecenoic acid
1.0897377
-
MS negative ion mode/HILIC
Acetoaceticacid
ME651496
Acetoacetic acid
1.0933565
-
MS negative ion mode/HILIC
Acetoaceticacid-2.7565882
ME651497
Acetoacetic acid
2.7565882
-
MS negative ion mode/HILIC
Acrylicacid
ME651502
Acrylic acid
1.9864882
-
MS negative ion mode/HILIC
Acrylicacid-2.8973038
ME651503
Acrylic acid
2.8973038
-
MS negative ion mode/HILIC
a-hydroxybutyrate
ME651505
2-Hydroxybutyric acid
1.3959937
-
MS negative ion mode/HILIC
a-hydroxybutyrate-1.537142
ME651506
2-Hydroxybutyric acid
1.537142
-
MS negative ion mode/HILIC
a-hydroxyisovalerate
ME651507
2-Hydroxy-3-methylbutyric acid
1.3313369
-
MS negative ion mode/HILIC
a-hydroxyisovalerate-2.912282
ME651508
2-Hydroxy-3-methylbutyric acid
2.912282
-
MS negative ion mode/HILIC
alpha-hydroxyisobutyrate
ME651513
2-Hydroxyisobutyric acid
3.114195
-
MS negative ion mode/HILIC
Citraconicacid
ME651529
Citraconic acid
1.0144638
-
MS negative ion mode/HILIC
Citraconicacid-1.722686
ME651530
Citraconic acid
1.722686
-
MS negative ion mode/HILIC
Citraconicacid-2.040095
ME651531
Citraconic acid
2.040095
-
MS negative ion mode/HILIC
Crotonicacid
ME651541
Crotonic acid
2.051878
-
MS negative ion mode/HILIC
Dihydroxyfumarate
ME651565
(E)-2,3-Dihydroxybut-2-enedioic acid
3.1242528
-
MS negative ion mode/HILIC
D-Leucicacid
ME651567
D-Leucic acid
1.3377998
-
MS negative ion mode/HILIC
Dodecanedioicacid
ME651568
Dodecanedioic acid
1.1223992
-
MS negative ion mode/HILIC
ethylmalonicacid
ME651578
Ethylmalonic acid
1.7097597
-
MS negative ion mode/HILIC
Glutaconicacid
ME651589
Glutaconic acid
3.123567
-
MS negative ion mode/HILIC
Glycolate
ME651593
Glycolic acid
1.9717411
-
MS negative ion mode/HILIC
Lauricacid
ME651628
Lauric acid
1.9753349
-
MS negative ion mode/HILIC
n-HexanoicAcid
ME651664
Caproic acid
1.1962534
-
MS negative ion mode/HILIC
Stearicacid
ME651709
Stearic acid
1.0380771
-
MS negative ion mode/HILIC
Stearicacid-1.975433
ME651710
Stearic acid
1.975433
-
MS negative ion mode/HILIC
12-oxo-10Z-dodecenoicacid
ME650132
12-Oxo-10Z-dodecenoic acid
9.341574
-
MS positive ion mode/C18
13E,17-octadecadienoicacid
ME650136
13E,17-Octadecadienoic acid
11.929294
-
MS positive ion mode/C18
13E,17-octadecadienoicacid+12.112559
ME650137
13E,17-Octadecadienoic acid
12.112559
-
MS positive ion mode/C18
13E,17-octadecadienoicacid+12.351626
ME650138
13E,17-Octadecadienoic acid
12.351626
-
MS positive ion mode/C18
2-amino-tetradecanoicacid
ME650181
2-Aminotetradecanoic acid
10.124633
-
MS positive ion mode/C18
2-decylenicacid
ME650183
2-Decenoic acid
13.437946
-
MS positive ion mode/C18
2-Hydroxyadipicacid
ME650187
2-Hydroxyadipic acid
0.65954983
-
MS positive ion mode/C18
2-Hydroxyadipicacid+0.9071934
ME650188
2-Hydroxyadipic acid
0.9071934
-
MS positive ion mode/C18
2-methylene-4-oxo-pentanedioicacid
ME650197
2-Methylene-4-oxopentanedioic acid
1.2540514
-
MS positive ion mode/C18
2R-aminohexadecanoicacid
ME650207
2R-Aminohexadecanoic acid
13.632786
-
MS positive ion mode/C18
3E,5E-tridecadienoicacid
ME650219
3E,5E-Tridecadienoic acid
8.258902
-
MS positive ion mode/C18
3-Hydroxycapricacid
ME650220
10-Hydroxydecanoic acid
4.474115
-
MS positive ion mode/C18
3-Hydroxycapricacid+4.517981
ME650221
10-Hydroxydecanoic acid
4.517981
-
MS positive ion mode/C18
3-Hydroxycapricacid+5.362054
ME650222
10-Hydroxydecanoic acid
5.362054
-
MS positive ion mode/C18
3-ketopalmiticacid
ME650224
3-Ketopalmitic acid
11.097533
-
MS positive ion mode/C18
3-methyl-tetradecanedioicacid
ME650226
3-Methyl-tetradecanedioic acid
11.875072
-
MS positive ion mode/C18
3-oxo-4-pentenoicacid
ME650230
3-Oxo-4-pentenoic acid
0.9091948
-
MS positive ion mode/C18
3-oxo-4-pentenoicacid+2.9779496
ME650231
3-Oxo-4-pentenoic acid
2.9779496
-
MS positive ion mode/C18
4,12-dihydroxy-hexadecanoicacid
ME650233
4,12-Dihydroxyhexadecanoic acid
12.011989
-
MS positive ion mode/C18
5,7-nonadienoicacid
ME650245
5,7-Nonadienoic acid
7.2969785
-
MS positive ion mode/C18
5-oxo-7-decynoicacid
ME650251
5-Oxo-7-Decynoic acid
4.084889
-
MS positive ion mode/C18
6,8-dihydroxy-octanoicacid
ME650252
6,8-Dihydroxyoctanoic acid
3.409535
-
MS positive ion mode/C18
6,8-dihydroxy-octanoicacid+4.223625
ME650253
6,8-Dihydroxyoctanoic acid
4.223625
-
MS positive ion mode/C18
6,9-hexadecadienoicacid
ME650254
6,9-Hexadecadienoic acid
11.004276
-
MS positive ion mode/C18
7,8-Diaminononanoate
ME650257
7,8-Diaminononanoic acid
0.84767085
-
MS positive ion mode/C18
7,8-Diaminononanoate+0.86831826
ME650258
7,8-Diaminononanoic acid
0.86831826
-
MS positive ion mode/C18
7-palmitoleicacid
ME650263
7-Palmitoleic acid
13.2631035
-
MS positive ion mode/C18
8-Amino-7-oxononanoate
ME650265
8-Amino-7-oxononanoic acid
1.2293361
-
MS positive ion mode/C18
8-Amino-7-oxononanoate+4.7958198
ME650266
8-Amino-7-oxononanoic acid
4.7958198
-
MS positive ion mode/C18
8-Amino-7-oxononanoate+5.501855
ME650267
8-Amino-7-oxononanoic acid
5.501855
-
MS positive ion mode/C18
8-AminoCaprylicacid
ME650268
8-Aminooctanoic acid
1.2355621
-
MS positive ion mode/C18
8S-hydroxy-2-Decene-4,6-diynoicacid
ME650276
8S-Hydroxy-2-decene-4,6-diynoic acid
13.156081
-
MS positive ion mode/C18
9,12,14-octadecatrienoicacid
ME650277
9,12,14-Octadecatrienoic acid
14.138994
-
MS positive ion mode/C18
9-lauroleicacid
ME650280
9-Dodecenoic acid
10.667505
-
MS positive ion mode/C18
9-lauroleicacid+12.430359
ME650281
9-Dodecenoic acid
12.430359
-
MS positive ion mode/C18
Acetoaceticacid
ME650282
Acetoacetic acid
0.9278046
-
MS positive ion mode/C18
beta-vinylacrylicacid
ME650319
beta-Vinyl acrylic acid
0.9089631
-
MS positive ion mode/C18
beta-vinylacrylicacid+3.1429625
ME650320
beta-Vinyl acrylic acid
3.1429625
-
MS positive ion mode/C18
D-Leucicacid
ME650389
D-Leucic acid
3.2223547
-
MS positive ion mode/C18
D-Leucicacid+3.3511949
ME650390
D-Leucic acid
3.3511949
-
MS positive ion mode/C18
D-Leucicacid+3.4208822
ME650391
D-Leucic acid
3.4208822
-
MS positive ion mode/C18
D-Leucicacid+3.683157
ME650392
D-Leucic acid
3.683157
-
MS positive ion mode/C18
D-Leucicacid+3.991298
ME650393
D-Leucic acid
3.991298
-
MS positive ion mode/C18
D-Leucicacid+4.228268
ME650394
D-Leucic acid
4.228268
-
MS positive ion mode/C18
Docosanedioicacid
ME650395
Docosanedioic acid
11.854422
-
MS positive ion mode/C18
(E)-2-Methylglutaconicacid
ME650123
2-Methylglutaconic acid
0.6715557
-
MS positive ion mode/C18
(E)-2-Methylglutaconicacid+0.8921491
ME650124
2-Methylglutaconic acid
0.8921491
-
MS positive ion mode/C18
(E)-2-Methylglutaconicacid+1.2437595
ME650125
2-Methylglutaconic acid
1.2437595
-
MS positive ion mode/C18
n-HexanoicAcid
ME650548
Caproic acid
7.8916845
-
MS positive ion mode/C18
n-HexanoicAcid+3.6519935
ME650549
Caproic acid
3.6519935
-
MS positive ion mode/C18
Oxaloglutarate
ME650562
2-Oxaloglutaric acid
0.77291054
-
MS positive ion mode/C18
11-amino-undecanoicacid
ME650691
11-Aminoundecanoic acid
4.9766893
-
MS positive ion mode/HILIC
12-oxo-10Z-dodecenoicacid
ME650696
12-Oxo-10Z-dodecenoic acid
1.0607969
-
MS positive ion mode/HILIC
12-oxo-9(Z)-dodecenoicacid
ME650698
12-Oxo-9Z-dodecenoic acid
1.20553
-
MS positive ion mode/HILIC
20-oxo-heneicosanoicacid
ME650727
20-Oxoheneicosanoic acid
1.0734895
-
MS positive ion mode/HILIC
2,3-Dihydroxyvalericacid
ME650724
2,3-Dihydroxyvaleric acid
2.3090968
-
MS positive ion mode/HILIC
2,3-Dihydroxyvalericacid+2.514446
ME650725
2,3-Dihydroxyvaleric acid
2.514446
-
MS positive ion mode/HILIC
2-Aminoisobutyricacid
ME650737
Aminoisobutyric acid
2.0614543
-
MS positive ion mode/HILIC
2-Hydroxyadipicacid
ME650744
2-Hydroxyadipic acid
2.0382087
-
MS positive ion mode/HILIC
2-Hydroxyadipicacid+2.4058414
ME650745
2-Hydroxyadipic acid
2.4058414
-
MS positive ion mode/HILIC
2-Methyl-3-ketovalericacid
ME650747
2-Methyl-3-ketovaleric acid
2.2828681
-
MS positive ion mode/HILIC
2-Octenedioicacid
ME650749
2-Octenedioic acid
1.2225144
-
MS positive ion mode/HILIC
2-octynoicacid
ME650750
2-Octynoic acid
1.18695
-
MS positive ion mode/HILIC
2-pentadecenoicacid
ME650753
2-Pentadecenoic acid
1.014031
-
MS positive ion mode/HILIC
2R-aminoheptanoicacid
ME650762
2R-Aminoheptanoic acid
1.2942362
-
MS positive ion mode/HILIC
3,5-hexadienoicacid
ME650766
3,5-Hexadienoic acid
1.0575975
-
MS positive ion mode/HILIC
3E,5E-tridecadienoicacid
ME650772
3E,5E-Tridecadienoic acid
1.1883309
-
MS positive ion mode/HILIC
3-ketopalmiticacid
ME650775
3-Ketopalmitic acid
1.0943156
-
MS positive ion mode/HILIC
3-methyl-hexanoicacid
ME650777
3-Methylcaproic acid
1.2008324
-
MS positive ion mode/HILIC
3-oxo-4-pentenoicacid
ME650779
3-Oxo-4-pentenoic acid
1.2264602
-
MS positive ion mode/HILIC
3-oxo-4-pentenoicacid+2.3765612
ME650780
3-Oxo-4-pentenoic acid
2.3765612
-
MS positive ion mode/HILIC
3-oxo-4-pentenoicacid+2.409796
ME650781
3-Oxo-4-pentenoic acid
2.409796
-
MS positive ion mode/HILIC
3-oxo-4-pentenoicacid+2.7539575
ME650782
3-Oxo-4-pentenoic acid
2.7539575
-
MS positive ion mode/HILIC
4-dodecynoicacid
ME650793
4-Dodecynoic acid
1.1849339
-
MS positive ion mode/HILIC
4-hydroxyenanthoicacid
ME650795
4-Hydroxyenanthoic acid
5.878981
-
MS positive ion mode/HILIC
5,7-nonadienoicacid
ME650802
5,7-Nonadienoic acid
1.1939015
-
MS positive ion mode/HILIC
5,7-nonadienoicacid+1.1411649
ME650803
5,7-Nonadienoic acid
1.1411649
-
MS positive ion mode/HILIC
5-oxo-7-decynoicacid
ME650811
5-Oxo-7-Decynoic acid
1.1634408
-
MS positive ion mode/HILIC
6,8-dihydroxy-octanoicacid
ME650813
6,8-Dihydroxyoctanoic acid
1.7909453
-
MS positive ion mode/HILIC
6-hydroxy-2-hexynoicacid
ME650815
6-Hydroxy-2-hexynoic acid
2.0531142
-
MS positive ion mode/HILIC
8-Amino-7-oxononanoate
ME650819
8-Amino-7-oxononanoic acid
1.4420108
-
MS positive ion mode/HILIC
8-AminoCaprylicacid
ME650820
8-Aminooctanoic acid
6.692213
-
MS positive ion mode/HILIC
8-AminoCaprylicacid+6.1462584
ME650821
8-Aminooctanoic acid
6.1462584
-
MS positive ion mode/HILIC
8-methoxy-13-hydroxy-9,11-octadecadienoicacid
ME650823
8-Methoxy-13-hydroxy-9,11-octadecadienoic acid
1.1073674
-
MS positive ion mode/HILIC
9-amino-nonanoicacid
ME650824
9-Aminononanoic acid
4.493635
-
MS positive ion mode/HILIC
9-oxo-2E-decenoicacid
ME650826
9-Oxo-2E-decenoic acid
1.1308458
-
MS positive ion mode/HILIC
9-oxo-2E-decenoicacid+1.1382291
ME650827
9-Oxo-2E-decenoic acid
1.1382291
-
MS positive ion mode/HILIC
Acrylicacid
ME650839
Acrylic acid
2.5108657
-
MS positive ion mode/HILIC
beta-vinylacrylicacid
ME650865
beta-Vinyl acrylic acid
2.3251603
-
MS positive ion mode/HILIC
beta-vinylacrylicacid+2.5160997
ME650866
beta-Vinyl acrylic acid
2.5160997
-
MS positive ion mode/HILIC
D-Leucicacid
ME650924
D-Leucic acid
1.6581211
-
MS positive ion mode/HILIC
D-Leucicacid+1.786733
ME650925
D-Leucic acid
1.786733
-
MS positive ion mode/HILIC
D-Leucicacid+2.1470613
ME650926
D-Leucic acid
2.1470613
-
MS positive ion mode/HILIC
(E)-2-Methylglutaconicacid
ME650676
2-Methylglutaconic acid
2.3901544
-
MS positive ion mode/HILIC
(E)-2-Methylglutaconicacid+2.4171734
ME650677
2-Methylglutaconic acid
2.4171734
-
MS positive ion mode/HILIC
(E)-2-Methylglutaconicacid+2.6466348
ME650678
2-Methylglutaconic acid
2.6466348
-
MS positive ion mode/HILIC
(E)-2-Methylglutaconicacid+2.796564
ME650679
2-Methylglutaconic acid
2.796564
-
MS positive ion mode/HILIC
(E)-2-Methylglutaconicacid+7.1963344
ME650680
2-Methylglutaconic acid
7.1963344
-
MS positive ion mode/HILIC
gamma-Aminobutryicacid
ME650953
gamma-Aminobutyric acid
1.7883953
-
MS positive ion mode/HILIC
n-HexanoicAcid
ME651063
Caproic acid
1.2316804
-
MS positive ion mode/HILIC
OctanoicAcid
ME651076
Caprylic acid
1.1346442
-
MS positive ion mode/HILIC
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