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Return to study ST001202 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
Benzene-1,2,4-triol
1,2,4-Trihydroxybenzene
ME284444
-
C02814
16.76240027
-
1-Methylhypoxanthine
1-Methylhypoxanthine
ME284548
-
-
9.283484835
-
2,3-Dihydroxyindole
2,3-Dihydroxyindole
ME284405
-
C02775
5.847727172
-
N5-acetyl-N5-hydroxy-L-ornithine
2,6-Diaminopimelic acid
ME284632
-
-
11.92874485
-
Anthranilate
2-Aminobenzoic acid
ME284512
-
C00108
11.85430615
-
Furfural
2-Furancarboxaldehyde
ME284422
-
C14279
17.30194815
-
2-Furoate
2-Furoic acid
ME284659
-
C01546
11.99902151
-
4-Hydroxy-4-methylglutamate
(2S,4S)-4-Amino-2-hydroxy-2-methylpentanedioic acid
ME284649
-
C06034
12.79382353
-
3-Amino-2-piperidone
3-Amino-2-piperidone
ME284635
-
-
10.73688116
-
(24R,24'R)-Fucosterol epoxide
(3beta,24R,24'R)-Fucosterol epoxide
ME284404
-
C03910
3.952373308
-
3-Butynoate
3-Butynoic acid
ME284402
-
C06144
11.06270121
-
4-Trimethylammoniobutanoate
3-Dehydroxycarnitine
ME284481
-
C01181
13.35695943
-
[ST] (5Z,7E)-9,10-seco-5,7,10(19)-cholestatriene
3-Deoxyvitamin D3
ME284412
-
-
3.809769388
-
3-Hydroxy-N6,N6,N6-trimethyl-L-lysine
3-Hydroxy-N6,N6,N6-trimethyl-lysine
ME284612
-
C01259
19.77212058
-
3-Methyleneoxindole
3-Methyleneoxindole
ME284553
-
C02796
8.792038785
-
Dihydrobiopterin
4a-Carbinolamine tetrahydrobiopterin
ME284549
-
C00268
10.4660135
-
4a-Hydroxytetrahydrobiopterin
4a-Hydroxytetrahydrobiopterin
ME284459
-
C15522
14.14148075
-
4-Aminobutanal
4-Aminobutyraldehyde
ME284703
-
C00555
10.44823076
-
4-Imidazolone-5-propanoate
4-Imidazolone-5-propionic acid
ME284508
-
C03680
10.98658091
-
5-6-Dihydrouridine
5,6-Dihydrouridine
ME284640
-
-
10.45821305
-
5-Acetamidopentanoate
5-Acetamidovaleric acid
ME284516
-
C03087
12.27921708
-
5-Hydroxytryptophan
5-Hydroxy-tryptophan
ME284615
-
C01017
10.78629718
-
5'-Methylthioadenosine
5'-Methylthioadenosine
ME284705
-
C00170
7.662818005
-
5S-HETE di-endoperoxide
5S-HETE di-endoperoxide
ME284737
-
-
4.018314767
-
6-Acetyl-D-glucose
6-Acetylglucose
ME284673
-
C02655
14.13062001
-
6-Hydroxyl-1,6-dihydropurine ribonucleoside
6-Hydroxyl-1,6-dihydropurine ribonucleoside
ME284519
-
C04583
14.61950598
-
6-methyltetrahydropterin
6-Methyltetrahydropterin
ME284695
-
-
10.2069161
-
Cholesta-5,7-dien-3beta-ol
7-Dehydrocholesterol
ME284362
-
C01164
5.034062003
-
8-Amino-7-oxononanoate
8-Amino-7-oxononanoic acid
ME284621
-
C01092
11.81871402
-
Acetyl-CoA
Acetyl-CoA
ME284650
-
C00024
12.2135231
-
Formyl-N-acetyl-5-methoxykynurenamine
Acetyl-N-formyl-5-methoxykynurenamine
ME284718
-
C05642
5.009405893
-
Adenine
Adenine
ME284613
-
C00147
9.666707457
-
Adenosine
Adenosine
ME284642
-
C00212
9.199460005
-
N6-(1,2-Dicarboxyethyl)-AMP
Adenylsuccinic acid
ME284410
-
C03794
17.91095153
-
Ala-Asn-Asp
Ala-Asn-Asp
ME284510
-
-
15.3021519
-
Ala-Asp
Ala-Asp
ME284403
-
-
15.26641194
-
Ala-Asp-Asp
Ala-Asp-Asp
ME284434
-
-
16.50734664
-
Ala-Asp-Gly
Ala-Asp-Gly
ME284676
-
-
15.17322567
-
Ala-Asp-Ser
Ala-Asp-Ser
ME284611
-
-
15.5160898
-
L-Alanine
Alanine
ME284601
-
C00041
14.67148587
-
Ala-Pro
Ala-Pro
ME284688
-
-
11.41465683
-
Ala-Ser
Ala-Ser
ME284606
-
-
21.72740523
-
Ala-Ser-Ser
Ala-Ser-Ser
ME284377
-
-
15.08418925
-
AMP
AMP
ME284657
-
C00020
13.64144062
-
L-Arginine
Arginine
ME284518
-
C00062
23.39583943
-
N-(L-Arginino)succinate
Argininosuccinic acid
ME284563
-
C03406
16.64803243
-
Asn-Asp
Asn-Asp
ME284684
-
-
15.52251039
-
Asn-Pro
Asn-Pro
ME284664
-
-
13.71037667
-
L-Asparagine
Asparagine
ME284543
-
C00152
15.16096719
-
Asp-Arg
Asp-Arg
ME284710
-
-
18.11574665
-
Asp-Asp
Asp-Asp
ME284478
-
-
17.08121967
-
Asp-Gly-Arg
Asp-Gly-Arg
ME284522
-
-
17.66001577
-
Asp-Ser
Asp-Ser
ME284644
-
-
15.42741362
-
beta-Citryl-L-glutamic acid
Beta-Citryl-glutamic acid
ME284509
-
-
19.51695717
-
Betaine
Betaine
ME284465
-
C00719
11.32153101
-
[FA (5:2)] 2,4-pentadienoic acid
beta-Vinyl acrylic acid
ME284726
-
-
13.81333902
-
Biotin
Biotin
ME284582
-
C00120
8.853017107
-
Biotin amide
Biotin amide
ME284707
-
C01893
10.58672224
-
Bis(2-ethylhexyl)phthalate
Bis(2-ethylhexyl)phthalate
ME284384
-
C03690
4.019740282
-
Hexadecasphinganine
C16 Sphinganine
ME284430
-
C13915
5.295501812
-
[SP (17:0)] heptadecasphinganine
C17 Sphinganine
ME284515
-
-
4.646360697
-
Camptothecin
Camptothecin
ME284638
-
C01897
13.03650093
-
Tetradecanoylcarnitine
CAR 14:0
ME284407
-
-
4.87684376
-
O-Palmitoyl-R-carnitine
CAR 16:0
ME284373
-
C02990
4.74346419
-
trans-Hexadec-2-enoylcarnitine
CAR 16:1(2E)
ME284363
-
-
4.792756782
-
Heptadecanoylcarnitine
CAR 17:0
ME284387
-
-
4.696531533
-
Stearoylcarnitine
CAR 18:0
ME284424
-
-
4.624172087
-
Oleoylcarnitine
CAR 18:1
ME284351
-
-
4.653362842
-
O-Acetylcarnitine
CAR 2:0
ME284538
-
C02571
11.0489917
-
Docosa-4-7-10-13-16-pentaenoylcarnitine
CAR 22:5
ME284355
-
-
4.55923195
-
O-Propanoylcarnitine
CAR 3:0
ME284494
-
C03017
9.865421733
-
Isobutyryl-L-carnitine
CAR 3:0;2Me
ME284629
-
-
8.948031402
-
2-Methylbutyroylcarnitine
CAR 4:0;2Me
ME284554
-
-
8.147832332
-
Hydroxybutyrylcarnitine
CAR 4:0;OH
ME284687
-
-
11.42415321
-
Tiglylcarnitine
CAR 4:1;2Me
ME284660
-
-
8.394592968
-
Hexanoylcarnitine
CAR 6:0
ME284342
-
-
7.680611847
-
Hydroxyhexanoycarnitine
CAR 6:0;OH
ME284479
-
-
9.248240277
-
N-Carbamyl-L-glutamate
Carglumic acid
ME284572
-
C05829
15.25018076
-
L-Carnitine
Carnitine
ME284537
-
C00487
13.29578202
-
CDP-choline
CDP-choline
ME284502
-
C00307
15.23544727
-
CDP-ribitol
CDP-ribitol
ME284578
-
C00789
16.33902117
-
[SP (16:0)] N-(hexadecanoyl)-sphing-4-enine
Cer 18:1;O2/16:0
ME284685
-
C00195
3.918032443
-
N-Lignoceroylsphingosine
Cer 18:1;O2/24:0
ME284722
-
-
5.23791707
-
[SP (24:0)] N-(15Z-tetracosenoyl)-sphing-4-enine
Cer 18:1;O2/24:1
ME284669
-
C00195
3.907768518
-
Cer(d40:2)
Cer 40:2;O2
ME284618
-
-
3.902274658
-
Cerulenin
Cerulenin
ME284699
-
C12058
10.38077012
-
Chelilutine
Chelilutine
ME284686
-
C12229
11.45563169
-
Chelirubine
Chelirubine
ME284734
-
C06327
12.46589862
-
Choline
Choline
ME284581
-
C00114
19.68091008
-
Choline phosphate
Choline phosphate
ME284455
-
C00588
14.92558874
-
Choline sulfate
Choline sulfate
ME284667
-
C00919
11.00788436
-
cis-1,2-Dihydroxy-1,2-dihydrodibenzothiophene
cis-1,2-dihydroxy-1,2-dihydrodibenzothiophene
ME284607
-
C06721
13.32006104
-
L-Citrulline
Citrulline
ME284496
-
C00327
15.82387926
-
CMP
CMP
ME284597
-
C00055
16.38478583
-
CMP-N-trimethyl-2-aminoethylphosphonate
CMP-2-trimethylaminoethylphosphonate
ME284495
-
C05674
14.3227792
-
Corydaline
Corydaline
ME284460
-
C15530
10.71030471
-
Creatine
Creatine
ME284558
-
C00300
14.60599193
-
Creatinine
Creatinine
ME284592
-
C00791
9.786476263
-
Crotanecine
Crotanecine
ME284470
-
C10284
13.73089929
-
Crotonoyl-CoA
Crotonoyl-CoA
ME284353
-
C00877
14.94937656
-
Cys-Gly-Pro
Cys-Gly-Pro
ME284433
-
-
10.56093323
-
Damascenine
Damascenine
ME284492
-
C10588
4.914876833
-
Decanoyl-CoA
Decanoyl-CoA
ME284591
-
C05274
14.17607005
-
Decitabine
Decitabine
ME284408
-
-
13.32743462
-
Deoxymannojirimycin
Deoxymannojirimycin
ME284544
-
C10141
15.74807895
-
dGMP
dGMP
ME284490
-
C00362
15.46956818
-
Di(2-ethylhexyl) adipate
Diethylhexyl adipate
ME284738
-
C14240
3.999194558
-
5,6-Dihydrothymine
Dihydrothymine
ME284539
-
C00906
14.73484139
-
N,N-Dimethylglycine
Dimethylglycine
ME284682
-
C01026
13.97676158
-
2,3-Dimethylmaleate
Dimethyl maleate
ME284546
-
C00922
13.65947529
-
MES
Dimethyl sulfone
ME284418
-
-
12.51969922
-
N2-(D-1-Carboxyethyl)-L-lysine
D-Lysopine
ME284634
-
C04020
17.05183895
-
N2-(D-1-Carboxyethyl)-L-arginine
D-Octopine
ME284598
-
C04137
17.08992343
-
4-(Trimethylammonio)but-2-enoate
(E)-4-(Trimethylammonio)but-2-enoate
ME284504
-
C04114
10.75159291
-
EPC(d33:1)
EPC 33:1;O2
ME284500
-
-
4.50835454
-
Ergothioneine
Ergothioneine
ME284600
-
C05570
14.7461537
-
D-Erythrose 4-phosphate
Erythrose 4-phosphate
ME284711
-
C00279
12.66300099
-
FAD
FAD
ME284467
-
C00016
11.3576134
-
Procollagen 5-(D-galactosyloxy)-L-lysine
Galactosylhydroxylysine
ME284446
-
C05547
16.60274766
-
4-Aminobutanoate
gamma-Aminobutyric acid
ME284648
-
C00334
15.36063795
-
1,4-Lactone
gamma-Butyrolactone
ME284715
-
C01770
13.85805828
-
gamma-Glutamyl-beta-cyanoalanine
gamma-Glutamyl-beta-cyanoalanine
ME284628
-
C05711
13.69828639
-
gamma-Glutamyl-Se-methylselenocysteine
gamma-Glutamyl-Se-methylselenocysteine
ME284463
-
C05695
15.96562142
-
GDP
GDP
ME284352
-
C00035
17.49992222
-
Ginkgotoxin
Ginkgotoxin
ME284706
-
-
5.03293472
-
Glu-Ala-Gly
Glu-Ala-Gly
ME284344
-
-
14.3003546
-
Glu-Ala-Ser
Glu-Ala-Ser
ME284677
-
-
14.58650027
-
D-Glucosamine
Glucosamine
ME284337
-
C00329
13.99015951
-
2-Amino-2-deoxy-D-gluconate
Glucosaminic acid
ME284511
-
C03752
16.9252545
-
Glucosylgalactosylhydroxylysine
Glucosylgalactosyl hydroxylysine
ME284506
-
-
21.73527707
-
Glu-Leu
Glu-Leu
ME284456
-
-
10.99379194
-
Glu-Met-Ser
Glu-Met-Ser
ME284608
-
-
11.90572206
-
Glu-Met-Thr
Glu-Met-Thr
ME284457
-
-
12.12871094
-
Glu-Pro
Glu-Pro
ME284436
-
-
14.92273393
-
L-Glutamine
Glutamine
ME284577
-
C00064
14.96905349
-
Glutathione
Glutathione
ME284401
-
C00051
14.06611358
-
Glu-Thr
Glu-Thr
ME284568
-
-
14.58107883
-
GMP
GMP
ME284645
-
C00144
16.475207
-
GTP
GTP
ME284489
-
C00044
18.63408225
-
Guanidinoacetate
Guanidoacetic acid
ME284525
-
C00581
15.69240258
-
Guanine
Guanine
ME284602
-
C00242
12.31548121
-
Hercynine
Hercynine
ME284665
-
C05575
12.28098773
-
L-Histidine
Histidine
ME284520
-
C00135
14.6248984
-
L-Homocitrulline
Homocitrulline
ME284345
-
C02427
15.11443181
-
gamma-L-Glutamyl-L-cysteinyl-beta-alanine
Homoglutathione
ME284474
-
C04544
13.042141
-
Hypoxanthine
Hypoxanthine
ME284573
-
C00262
10.22818795
-
IDP
IDP
ME284559
-
C00104
16.40784163
-
Imidazole-4-acetate
Imidazoleacetic acid
ME284473
-
C02835
11.43835376
-
Indole
Indole
ME284550
-
C00463
11.6137433
-
Indoleacrylicacid
Indoleacrylic acid
ME284562
-
-
8.793852715
-
Inosine
Inosine
ME284721
-
C00294
10.91208891
-
D-myo-Inositol 1,2-cyclic phosphate
Inositol cyclic phosphate
ME284701
-
C04299
15.62612801
-
L-Isoleucine
Isoleucine
ME284532
-
C00407
10.85906504
-
Kievitone hydrate
Kievitone hydrate
ME284560
-
C02549
10.23568933
-
(S)-Lactate
Lactic acid
ME284693
-
C00186
13.87270405
-
Lactose
Lactose
ME284454
-
C00243
16.18258972
-
Hypaphorine
Lenticin
ME284547
-
C09213
8.79236713
-
Leu-Ala
Leu-Ala
ME284530
-
-
12.79281495
-
Leu-Asp
Leu-Asp
ME284556
-
-
12.33934831
-
L-Leucine
Leucine
ME284524
-
C00123
11.23797393
-
Leu-Lys-Pro
Leu-Lys-Pro
ME284575
-
-
21.08965438
-
Leu-Pro
Leu-Pro
ME284507
-
-
13.06751081
-
Leu-Ser
Leu-Ser
ME284346
-
-
13.01896544
-
L-Glutamate 5-semialdehyde
L-Glutamic-gamma-semialdehyde
ME284723
-
C01165
14.38091532
-
Lotaustralin
Lotaustralin
ME284596
-
C08334
12.87347998
-
[LysoPC(14:0)] 1-tetradecanoyl-sn-glycero-3-phosph...
LPC 14:0
ME284374
-
C04230
4.946485488
-
LysoPC(16:0)
LPC 16:0
ME284429
-
C04230
4.843866878
-
LysoPC(16:1)
LPC 16:1
ME284389
-
-
4.861953393
-
LysoPC(18:0)
LPC 18:0
ME284485
-
C04230
4.7274387
-
LysoPC(18:1)
LPC 18:1
ME284397
-
-
4.755195303
-
LysoPC(20:0)
LPC 20:0
ME284417
-
C04230
4.611579715
-
LysoPC(20:4)
LPC 20:4
ME284372
-
C04230
4.722534218
-
[LysoPC(16:2)] 1-hexadecyl-sn-glycero-3-phosphocho...
LPC O-16:0
ME284449
-
C13903
4.888184587
-
LysoPC(O-16:1)
LPC O-16:1
ME284376
-
-
4.773981055
-
LysoPC(O-18:0)
LPC O-18:0
ME284462
-
-
4.76737845
-
LysoPE(18:0)
LPE 18:0
ME284471
-
-
4.892530615
-
LysoPE(18:1)
LPE 18:1
ME284426
-
-
4.852678577
-
LysoPE(20:0)
LPE 20:0
ME284414
-
-
4.78514025
-
LysoPE(20:1)
LPE 20:1
ME284368
-
-
4.923818928
-
LysoPE(20:4)
LPE 20:4
ME284393
-
-
4.697636057
-
LysoPE(22:0)
LPE 22:0
ME284413
-
-
4.66780746
-
LysoPE(P-20:0)
LPE P-20:0
ME284445
-
-
4.7280112
-
Lycomarasmine B
Lycomarasmine
ME284714
-
C08496
15.61493198
-
Lys-Asp
Lys-Asp
ME284590
-
-
18.02081535
-
L-Lysine
Lysine
ME284464
-
C00047
22.49594985
-
Lys-Ser
Lys-Ser
ME284670
-
-
16.427867
-
Lys-Thr-Ser
Lys-Thr-Ser
ME284588
-
-
15.41594634
-
Lys-Thr-Thr
Lys-Thr-Thr
ME284527
-
-
15.33570159
-
Lys-Thr-Val
Lys-Thr-Val
ME284702
-
-
17.4070664
-
Lys-Val
Lys-Val
ME284501
-
-
21.84600675
-
Maleamate
Maleamate
ME284574
-
C01596
14.9201399
-
Met-Ala-Gly
Met-Ala-Gly
ME284656
-
-
12.6421314
-
Methacholine
Methacholine
ME284483
-
C07471
13.35650977
-
L-Methionine
Methionine
ME284382
-
C00073
11.52268348
-
DL-Methionine sulfone
Methionine sulfone
ME284619
-
-
11.76954213
-
L-Methionine S-oxide
Methionine sulfoxide
ME284499
-
C02989
13.31547408
-
Methocarbamol
Methocarbamol
ME284443
-
-
4.992828235
-
Methyl 2-diazoacetamidohexonate
Methyl 2-diazoacetamidohexonate
ME284652
-
C01223
14.15646265
-
Met-Ser
Met-Ser
ME284360
-
-
10.47866973
-
2-Ethylhexyl phthalate
Monoethylhexyl phthalic acid
ME284378
-
C03343
4.155649798
-
Muramic acid
Muramic acid
ME284513
-
C06470
14.36168943
-
N2-Succinyl-L-ornithine
N2-Succinylornithine
ME284646
-
C03415
13.65848652
-
N4-Acetylaminobutanal
N4-Acetylaminobutanal
ME284720
-
C05936
7.773494275
-
N6-Acetyl-N6-hydroxy-L-lysine
N(6)-Acetyl-N(6)-hydroxy-lysine
ME284551
-
C03955
11.9010893
-
Ne,Ne dimethyllysine
N(6),N(6)-Dimethyl-lysine
ME284452
-
C05545
20.94353832
-
N6,N6,N6-Trimethyl-L-lysine
N-6-Trimethyllysine
ME284584
-
C03793
21.32134673
-
N2-Acetyl-L-aminoadipate
N-Acetyl-2-aminoadipic acid
ME284627
-
C12986
12.19616507
-
N-Acetyl-beta-D-glucosaminylamine
N-Acetyl-beta-glucosaminylamine
ME284557
-
C01239
13.08605649
-
N-Acetylcadaverine
N-Acetylcadaverine
ME284730
-
-
10.49508648
-
N-Acetyllactosamine
N-Acetyllactosamine
ME284498
-
C00611
13.74973206
-
N-Acetyl-L-leucine
N-Acetylleucine
ME284488
-
C02710
11.8369078
-
N-Acetyl-D-mannosamine
N-Acetyl-mannosamine
ME284690
-
C00645
12.30823628
-
N-Acetylputrescine
N-Acetylputrescine
ME284610
-
C02714
18.437908
-
NAD+
NAD
ME284514
-
C00003
14.03279198
-
NADH
NADH
ME284675
-
C00004
13.20262861
-
NADP+
NADP
ME284484
-
C00006
16.52036781
-
NADPH
NADPH
ME284689
-
C00005
16.8146858
-
N(alpha)-Benzyloxycarbonyl-L-leucine
N-Benzyloxycarbonyl-L-leucine
ME284697
-
C04335
8.419790313
-
Nebrosteroid M
Nebrosteroid M
ME284381
-
-
3.989278388
-
N-Ethylmaleimide
N-Ethylmaleimide
ME284593
-
C02441
12.24443284
-
Neuraminic acid
Neuraminic acid
ME284637
-
C06469
16.73769088
-
N-Formyl-L-methionine
N-Formylmethionine
ME284587
-
C03145
8.234353748
-
N-Gluconyl ethanolamine
N-Gluconyl ethanolamine
ME284708
-
-
14.43377591
-
N-Gluconyl ethanolamine phosphate
N-Gluconyl ethanolamine phosphate
ME284545
-
-
14.68326934
-
N-hydroxyisoleucine
N-hydroxyisoleucine
ME284605
-
-
12.18455899
-
Nicotinamide
Niacinamide
ME284717
-
C00153
7.700104078
-
Nicotinamide D-ribonucleotide
Nicotinamide ribotide
ME284555
-
C00455
15.1844966
-
N-oleoyl tyrosine
N-Oleoyl tyrosine
ME284340
-
-
4.663268677
-
Norepinephrinesulfate
Norepinephrine sulfate
ME284580
-
-
18.48614685
-
5-Nitro-2-(3-phenylpropylamino)benzoic acid
NPPB
ME284579
-
C13705
4.909320407
-
N-Ribosylhistidine
N-Ribosylhistidine
ME284683
-
-
15.27689489
-
N-stearoyl tyrosine
N-Stearoyl tyrosine
ME284343
-
-
4.625341473
-
N-Sulfo-D-glucosamine
N-Sulfo-glucosamine
ME284681
-
C01075
16.99567797
-
O-Acetyl-L-homoserine
O-Acetyl-homoserine
ME284631
-
C01077
11.13088541
-
Ophthalmicacid
Ophthalmic acid
ME284655
-
-
13.2685989
-
L-Ornithine
Ornithine
ME284493
-
C00077
21.73495193
-
Otonecine
Otonecine
ME284704
-
C10356
11.21632449
-
Glutathione disulfide
Oxidized glutathione
ME284622
-
C00127
17.17437355
-
Pantothenate
Pantothenic acid
ME284663
-
C00864
8.738466575
-
PC(14:1)
PC 14:1
ME284653
-
-
4.895970757
-
PC(18:2)
PC 18:2
ME284472
-
-
4.797984965
-
PC(30:0)
PC 30:0
ME284680
-
-
4.16149099
-
PC(32:0)
PC 32:0
ME284643
-
-
4.12601889
-
PC(32:1)
PC 32:1
ME284411
-
C00157
4.124463423
-
PC(34:1)
PC 34:1
ME284386
-
-
4.107391092
-
PC(34:2)
PC 34:2
ME284350
-
-
4.102637573
-
PC(36:2)
PC 36:2
ME284364
-
-
4.067209768
-
PC(36:3)
PC 36:3
ME284731
-
-
4.583168153
-
PC(36:4)
PC 36:4
ME284370
-
-
4.067309173
-
PC(38:4)
PC 38:4
ME284359
-
-
4.018699773
-
PC(38:6)
PC 38:6
ME284361
-
-
4.033659615
-
PC(40:5)
PC 40:5
ME284365
-
-
4.006347635
-
PC(40:6)
PC 40:6
ME284394
-
-
3.994401687
-
PC(40:7)
PC 40:7
ME284383
-
-
4.011548855
-
PE(32:0)
PE 32:0
ME284542
-
-
3.780143518
-
PE(32:1)
PE 32:1
ME284491
-
-
3.818267462
-
PE(34:3)
PE 34:3
ME284348
-
-
3.886038732
-
PE(36:0)
PE 36:0
ME284599
-
-
4.115827133
-
PE(36:4)
PE 36:4
ME284428
-
-
3.99118925
-
PE(38:1)
PE 38:1
ME284391
-
-
4.07689911
-
PE(38:6)
PE 38:6
ME284392
-
-
3.957402455
-
PE(O-38:5)
PE O-38:5
ME284420
-
C00350
3.957100522
-
PE(P-34:1)
PE P-34:1
ME284636
-
C00350
4.06369411
-
PE(P-36:2)
PE P-36:2
ME284497
-
C00350
4.082290758
-
PE(P-36:3)
PE P-36:3
ME284347
-
-
4.045685475
-
PE(P-36:4)
PE P-36:4
ME284395
-
C00350
3.989776665
-
PE(P-38:5)
PE P-38:5
ME284367
-
C00350
3.957540827
-
PE(P-38:6)
PE P-38:6
ME284425
-
-
3.942765652
-
PE(P-40:5)
PE P-40:5
ME284453
-
-
3.926566673
-
PE(P-40:6)
PE P-40:6
ME284566
-
-
3.914204575
-
L-Phenylalanine
Phenylalanine
ME284570
-
C00079
10.2328817
-
Phosphocreatine
Phosphocreatine
ME284447
-
C02305
14.99096929
-
Ethanolamine phosphate
Phosphoethanolamine
ME284617
-
C00346
15.82747256
-
L-Pipecolate
Pipecolic acid
ME284674
-
C00408
12.40688209
-
Proclavaminic acid
Proclavaminic acid
ME284439
-
C06658
9.839361323
-
L-Proline
Proline
ME284586
-
C00148
12.7755513
-
PS(34:0)
PS 34:0
ME284725
-
-
3.782984902
-
PS(36:5)
PS 36:5
ME284415
-
-
3.794331103
-
PS(40:5)
PS 40:5
ME284533
-
-
3.751749782
-
Pyridoxal
Pyridoxal
ME284672
-
C00250
8.188293105
-
Pyridoxine
Pyridoxine
ME284604
-
C00314
8.24081727
-
Pyridoxine phosphate
Pyridoxine 5'-phosphate
ME284567
-
C00627
13.68567782
-
Quinoline
Quinoline
ME284569
-
C06413
11.58411373
-
Ribitol
Ribitol
ME284658
-
C00474
12.92584053
-
S-(2-Hydroxyethyl)glutathione
S-(2-Hydroxyethyl)glutathione
ME284651
-
C14875
12.93283003
-
[FA oxo,amino(6:0)] 3-oxo-5S-amino-hexanoic acid
(S)-5-Amino-3-oxohexanoate
ME284466
-
C03656
12.44203498
-
S-Adenosyl-L-homocysteine
S-Adenosylhomocysteine
ME284595
-
C00021
13.57210071
-
S-Adenosyl-L-methionine
S-Adenosylmethionine
ME284487
-
C00019
16.30172518
-
Sanguinarine
Sanguinarine
ME284700
-
C06162
13.20807094
-
S-Cysteinosuccinic acid
S-Cysteinosuccinic acid
ME284469
-
-
16.92657993
-
L-Serine
Serine
ME284505
-
C00065
15.64468996
-
S-glutathionyl-L-cysteine
S-Glutathionyl-cysteine
ME284476
-
C05526
16.80479838
-
Homostachydrine
(S)-Homostachydrine
ME284727
-
C08283
10.11317431
-
(R)-S-Lactoylglutathione
S-Lactoylglutathione
ME284733
-
C03451
13.16827206
-
Slaframine
Slaframine
ME284529
-
C06185
10.12321105
-
SM(d18:0/24:1(15Z))
SM 18:0;O2/24:1(15Z)
ME284468
-
C00550
5.094556533
-
SM(d18:1/24:1(15Z))
SM 18:1;O2/24:1(15Z)
ME284366
-
C00550
4.764285583
-
SM(d32:1)
SM 32:1;O2
ME284668
-
-
4.457616562
-
SM(d32:2)
SM 32:2;O2
ME284441
-
-
4.449498875
-
SM(d33:1)
SM 33:1;O2
ME284712
-
-
4.451195202
-
SM(d34:1)
SM 34:1;O2
ME284728
-
-
4.430059222
-
SM(d34:2)
SM 34:2;O2
ME284534
-
-
4.403318462
-
SM(d35:1)
SM 35:1;O2
ME284735
-
-
4.456868753
-
SM(d36:1)
SM 36:1;O2
ME284709
-
C00550
4.479773665
-
SM(d38:1)
SM 38:1;O2
ME284431
-
C00550
4.733348182
-
SM(d38:2)
SM 38:2;O2
ME284461
-
-
4.360023768
-
SM(d40:1)
SM 40:1;O2
ME284358
-
C00550
6.39559826
-
SM(d40:2)
SM 40:2;O2
ME284589
-
-
4.365703202
-
SM(d41:1)
SM 41:1;O2
ME284409
-
-
4.841385622
-
SM(d41:2)
SM 41:2;O2
ME284435
-
-
4.516277398
-
SM(d42:3)
SM 42:3;O2
ME284448
-
-
4.325904345
-
SM(d43:1)
SM 43:1;O2
ME284339
-
-
7.618731983
-
SM(d44:1)
SM 44:1;O2
ME284438
-
C00550
5.117442805
-
SM(d44:2)
SM 44:2;O2
ME284379
-
-
4.982571833
-
sn-glycero-3-Phosphocholine
sn-Glycero-3-phosphocholine
ME284523
-
C00670
14.44752918
-
sn-glycero-3-Phosphoethanolamine
sn-Glycero-3-phosphoethanolamine
ME284625
-
C01233
15.54134505
-
Glycerophosphoglycerol
sn-Glycero-3-phosphoglycerol
ME284662
-
C03274
12.59396679
-
[SP] Sphinganine-1-phosphate
Sphinganine 1-phosphate
ME284716
-
C01120
5.016144177
-
[SP] Sphing-4-enine
Sphingosine
ME284398
-
C00319
4.498499263
-
Sulfacetamide
Sulfacetamide
ME284561
-
-
9.023974753
-
Tetrapentylammonium
Tetrapentylammonium
ME284719
-
C13815
7.666441038
-
Thiamin
Thiamine
ME284623
-
C00378
20.01868013
-
Thiamin diphosphate
Thiamine diphosphate
ME284354
-
C00068
14.53762283
-
Thr-Ala
Thr-Ala
ME284400
-
-
17.16055265
-
Thr-Ala-Ser
Thr-Ala-Ser
ME284552
-
-
16.08407441
-
Thr-Asp
Thr-Asp
ME284614
-
-
15.46196741
-
L-Threonine
Threonine
ME284480
-
C00188
14.34989966
-
Thr-Thr-Asp
Thr-Thr-Asp
ME284583
-
-
15.84870425
-
Thr-Trp-Cys
Thr-Trp-Cys
ME284565
-
-
15.41052224
-
Triethanolamine
Triethanolamine
ME284380
-
-
9.410876677
-
L-Tryptophan
Tryptophan
ME284369
-
C00078
11.58145056
-
Tussilagine
Tussilagine
ME284633
-
C10411
10.48585254
-
L-Tyrosine
Tyrosine
ME284535
-
C00082
12.93151952
-
UDP
UDP
ME284531
-
C00015
16.06002061
-
Undecanoylcholine
Undecanoylcholine
ME284396
-
-
4.46388057
-
Urolithin B
Urolithin B
ME284698
-
-
11.55364935
-
Val-Ala
Val-Ala
ME284576
-
-
12.19959091
-
L-Valine
Valine
ME284503
-
C00183
12.45411466
-
Vicine
Vicine
ME284647
-
C08437
15.79978603
-
Vinylacetylglycine
Vinylacetylglycine
ME284609
-
-
12.16446868
-
[SP (14:0)] 1-deoxy-tetradecasphinganine
Xestoaminol C
ME284357
-
-
4.869975467
-
1-(14-methyl-pentadecanoyl)-2-(8-[3]-ladderane-oct...
-
ME284475
-
-
3.762884133
-
1,6-diaminohexane
-
ME284732
-
-
13.2630301
-
2-(4-sulfophenyl)butyrate
-
ME284406
-
-
13.75506912
-
2-amino-3,7-dideoxy-D-threo-hept-6-ulosonate
-
ME284696
-
-
12.75322283
-
2-hydroxy-3-carboxy-4,5-cyclopropylhex-5-enoate
-
ME284371
-
-
14.10302042
-
2-Hydroxy-cis-hex-2,4-dienoate
-
ME284692
-
C11354
13.82568866
-
3-(1-Pyrrolidinyl)-2-pentanone
-
ME284486
-
-
5.033839957
-
3-nitro-2-pentanol
-
ME284736
-
-
8.715304765
-
4-amino-4-deoxy-L-arabinose
-
ME284724
-
-
15.57812047
-
(+/-)-5-[(tert-Butylamino)-2'-hydroxypropoxy]-1,2,...
-
ME284349
-
C04875
4.194756508
-
6-diazo-5-oxonorleucine
-
ME284416
-
-
14.91783346
-
7,8-H2pterin-6-ylmethyl-l-(4-aminophenyl)-1-deoxy-...
-
ME284423
-
-
8.72128055
-
Acetylpseudotropine
-
ME284385
-
C12453
11.05018277
-
a Cysteine adduct
-
ME284713
-
-
14.79385998
-
ADP ribose 1'',2''-phosphate
-
ME284540
-
-
17.76371693
-
Ala-Ala-Ala-Ser
-
ME284594
-
-
17.79253828
-
Ala-Asp-Asp-Cys
-
ME284691
-
-
15.83759623
-
Ala-Asp-Cys-Ser
-
ME284639
-
-
17.08953852
-
Ala-Asp-Gly-Tyr
-
ME284654
-
-
11.406627
-
Ala-Leu-Lys-Asp
-
ME284616
-
-
13.35835595
-
Ala-Leu-Thr-Ala
-
ME284536
-
-
14.50803516
-
Ala-Thr-Ala-Asp
-
ME284679
-
-
17.07347068
-
Ala-Thr-Ala-Ser
-
ME284477
-
-
16.40690918
-
Ala-Trp-Gly-Gly
-
ME284630
-
-
13.88946598
-
Ala-Val-Asp-Ser
-
ME284641
-
-
16.89301348
-
alpha-(2,6-anhydro-3-deoxy-D-arabino-heptulopyrano...
-
ME284571
-
-
15.93827537
-
Arg-Asp-Asp-Gly
-
ME284526
-
-
16.93506642
-
Arsenobetaine
-
ME284427
-
-
11.15181713
-
Asn-Asn-Gly-His
-
ME284440
-
-
14.73123108
-
Asn-Leu-Pro-Pro
-
ME284458
-
-
10.8581661
-
Asn-Thr-Asn-Asn
-
ME284678
-
-
17.75958785
-
Asparaginyl-Hydroxyproline
-
ME284482
-
-
12.53808897
-
Asp-Leu-Gln-Pro
-
ME284517
-
-
12.41094516
-
Asp-Leu-Lys-Asp
-
ME284585
-
-
13.890408
-
Asp-Leu-Lys-Lys
-
ME284603
-
-
22.02257995
-
Asp-Val-Gly-Ser
-
ME284528
-
-
16.67746102
-
Bisacurone epoxide
-
ME284450
-
-
4.188265113
-
Cohibin C
-
ME284419
-
-
3.768894825
-
CTAB
-
ME284390
-
C11275
8.199824063
-
Cysteinyl-Hydroxyproline
-
ME284620
-
-
8.00608417
-
deacetylcolchicine
-
ME284442
-
C16712
14.96645758
-
dibenzothiophene-5-oxide
-
ME284666
-
-
11.84448503
-
D-O-Phosphoserine
-
ME284437
-
C02532
17.18560077
-
gamma-thiomethyl glutamate
-
ME284432
-
-
14.54663835
-
Ganglioside GA1 (d18:1/24:0)
-
ME284399
-
C06136
7.757340693
-
Hexadeceylamin
-
ME284375
-
-
7.65975478
-
Lactosylceramide(d18
-
ME284336
-
C01290
7.601925128
-
methiin
-
ME284694
-
-
10.46352237
-
Montecristin
-
ME284341
-
-
3.77281814
-
MOPS
-
ME284421
-
-
11.21562697
-
N2-Acetyl-L-aminoadipyl-delta-phosphate
-
ME284451
-
C12987
16.60683972
-
N-(5-Methyl-3-oxohexyl)alanine
-
ME284338
-
-
10.53412455
-
N-dimethylethanolamine
-
ME284626
-
-
16.64034317
-
O-9Z,12Z-Hexadecadienoyl-R-carnitine
-
ME284356
-
-
4.693818675
-
O-Acetylneuraminic acid
-
ME284671
-
C03525
14.68796631
-
Ovothiol disulfide
-
ME284624
-
-
15.76400124
-
(R)-2-Ethylmalate
-
ME284661
-
C02488
13.88382331
-
Sesaminol glucosyl-(1->2)-[glucosyl-(1->6)]-glucos...
-
ME284729
-
-
20.74661935
-
[ST hydroxy(3:2/3:0/3:0)] (5Z,7E)-(1R,2R,3R)-3-(hy...
-
ME284388
-
-
3.963792765
-
Tolylacetonitrile
-
ME284541
-
C02596
11.58379063
-
Trp-Trp-Tyr-Tyr
-
ME284521
-
-
10.46461574
-
xi-4,5-Dihydro-2,4(5)-dimethyl-1H-imidazole
-
ME284564
-
-
10.46742155
-
Analysis: pHILIC NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
[6]-Paradol
1-(4-Hydroxy-3-methoxyphenyl)-3-decanone
ME284881
-
C10482
4.066179118
-
(S)-1-Pyrroline-5-carboxylate
1-Pyrroline-5-carboxylic acid
ME284970
-
C03912
14.67882617
-
2-Acetolactate
2-Acetolactate
ME284823
-
C00900
12.65981349
-
2(alpha-D-Mannosyl)-D-glycerate
2-(alpha-D-mannosyl)-D-glyceric acid
ME284925
-
C11544
14.72291865
-
2-Amino-9,10-epoxy-8-oxodecanoic acid
2-Amino-9,10-epoxy-8-oxodecanoic acid
ME284965
-
C12027
12.82307869
-
2-Deoxy-2,3-dehydro-N-acetylneuraminic acid
2-Deoxy-2,3-dehydro-N-acetylneuraminic acid
ME284927
-
C04580
12.37986465
-
2-Dodecylbenzenesulfonic acid
2-Dodecylbenzenesulfonic acid
ME284981
-
-
3.80485787
-
2-Hydroxyethanesulfonate
2-Hydroxyethanesulfonate
ME284967
-
C05123
10.54127598
-
(R)-2-Hydroxyglutarate
2-Hydroxyglutaric acid
ME284813
-
C01087
14.87293344
-
2-Hydroxy-2,4-pentadienoate
2-Hydroxypenta-2,4-dienoic acid
ME284982
-
C00596
14.72384022
-
[FA oxo(6:0)] 2-oxo-hexanoic acid
2-Ketocaproic acid
ME284910
-
C00902
4.985347547
-
2-Methyl-4-propyl-1,3-oxathiane
2-Methyl-4-propyl-1,3-oxathiane
ME284834
-
-
5.030609007
-
2-Oxoglutarate
2-Oxoglutaric acid
ME284961
-
C00026
15.25062816
-
2-trans,6-trans-Farnesal
(2-trans,6-trans)-Farnesal
ME284810
-
C03461
4.4024093
-
3,3'-Thiobispropanoic acid
3,3'-Thiobispropanoic acid
ME284932
-
-
7.692007188
-
3-deoxy-D-galactose
3-Deoxygalactose
ME284773
-
-
12.28132603
-
3-Phospho-D-glyceroyl phosphate
3-Phospho-D-glyceroyl dihydrogen phosphate
ME284891
-
C00236
17.6238814
-
3-Phospho-D-glycerate
3-Phosphoglyceric acid
ME284902
-
C00197
16.66291461
-
4-Amino-4-deoxychorismate
4-Amino-4-deoxychorismic acid
ME284805
-
C11355
13.02271246
-
4-Nitroaniline
4-Nitroaniline
ME284759
-
C02126
7.706277522
-
5-Acetyl-2,4-dimethyloxazole
5-Acetyl-2,4-dimethyloxazole
ME284935
-
-
7.710850447
-
5'-Dehydroadenosine
5'-Dehydroadenosine
ME284939
-
C11500
10.17984785
-
6-Phospho-D-gluconate
6-Phosphogluconic acid
ME284861
-
C00345
17.30976467
-
7E,9E,11-Dodecatrienyl acetate
7E,9E,11-Dodecatrienyl acetate
ME284878
-
-
4.252984773
-
9-Oxononanoic acid
9-Oxo-nonanoic acid
ME284785
-
C16322
4.941651432
-
[FA (18:1)] 9R,10S-epoxy-12Z-octadecenoic acid
9R,10S-EpOME
ME284741
-
C14825
4.056940532
-
(S)-2-Aceto-2-hydroxybutanoate
Acetohydroxybutyric acid
ME284751
-
C06006
14.26764648
-
ADP
ADP
ME284816
-
C00008
14.86599087
-
1-(5'-Phosphoribosyl)-5-amino-4-imidazolecarboxami...
AICAR
ME284955
-
C04677
15.22405416
-
alpha-Irone
alpha-Irone
ME284768
-
C09690
4.293084262
-
[FA (18:3)] 9Z,12Z,15Z-octadecatrienoic acid
alpha-Linolenic acid
ME284750
-
C06427
3.9717036
-
(S)-AMPA
Ampa
ME284893
-
C13672
14.15348501
-
ancymidol
Ancymidol
ME284890
-
-
4.904645135
-
D-Arabinonate
Arabinonic acid
ME284956
-
C00878
13.36413393
-
FA (20:0)
Arachidic acid
ME284758
-
C06425
3.912773355
-
Asn-Cys-Cys
Asn-Cys-Cys
ME284857
-
-
14.48680304
-
L-Aspartate
Aspartic acid
ME284942
-
C00049
14.77546658
-
Asp-Asp-Gly
Asp-Asp-Gly
ME284847
-
-
16.79027927
-
Aspartyl-L-proline
Asp-Pro
ME284897
-
-
15.25447792
-
ATP
ATP
ME284817
-
C00002
16.0186724
-
Bakkenolide A
Bakkenolide A
ME284752
-
C09350
4.268384757
-
Docosanoic acid
Behenic acid
ME284789
-
C08281
3.866781172
-
Bendiocarb
Bendiocarb
ME284777
-
C14433
4.499612745
-
Benzyl sulfate
Benzyl sulfate
ME284851
-
-
4.502936445
-
Decanoic acid
Capric acid
ME284765
-
C01571
4.282984872
-
Hexanoic acid
Caproic acid
ME284877
-
C01585
5.00626485
-
FA (8:0) octanoic acid
Caprylic acid
ME284842
-
C06423
4.57476943
-
N-Carbamoyl-L-aspartate
Carbamoylaspartate
ME284781
-
C00438
16.39767794
-
CDP-ethanolamine
CDP-Ethanolamine
ME284947
-
C00570
16.19225764
-
Cholesterolsulfate
Cholesterol sulfate
ME284835
-
-
3.73565122
-
cis-Aconitate
cis-Aconitic acid
ME284946
-
C00417
17.45472742
-
[FA (20:1)] 11Z-eicosenoic acid
cis-Gondoic acid
ME284748
-
C16526
3.896584853
-
Citrate
Citric acid
ME284950
-
C00158
17.68765238
-
CMP-2-aminoethylphosphonate
CMPciliatine
ME284876
-
C05673
15.16419106
-
CTP
CTP
ME284856
-
C00063
17.51035475
-
Cyclic ADP-ribose
Cyclic ADP-ribose
ME284934
-
C13050
14.07083704
-
dATP
dATP
ME284871
-
C00131
15.24156001
-
2-Deoxy-D-ribose 5-phosphate
Deoxyribose 5-phosphate
ME284818
-
C00673
14.56986387
-
D-erythro-D-galacto-octitol
D-Erythro-D-galacto-octitol
ME284962
-
-
15.45472415
-
dGDP
dGDP
ME284843
-
C00361
16.01722625
-
Digitalin
Digitalin
ME284771
-
C08862
14.95920093
-
Glycerone phosphate
Dihydroxyacetone phosphate
ME284854
-
C00111
15.13153635
-
1D-myo-Inositol 3,4,5,6-tetrakisphosphate
D-myo-Inositol 3,4,5,6-tetrakisphosphate
ME284983
-
C04520
19.28244445
-
[FA (22:5)] 7Z,10Z,13Z,16Z,19Z-docosapentaenoic ac...
DPA
ME284838
-
C16513
3.902910697
-
D-Ribitol 5-phosphate
D-Ribitol 5-phosphate
ME284915
-
C01068
15.45846773
-
D-Sedoheptulose 7-phosphate
D-Sedoheptulose 7-phosphate
ME284921
-
C05382
15.94497738
-
Erythronicacid
Erythronic acid
ME284779
-
-
16.07137807
-
D-Erythrose
Erythrose
ME284952
-
C01796
10.54554154
-
D-Fructose
Fructose
ME284766
-
C00095
17.00370657
-
D-Fructose 1,6-bisphosphate
Fructose 1,6-bisphosphate
ME284833
-
C00354
17.6274918
-
D-Fructose 6-phosphate
Fructose 6-phosphate
ME284755
-
C00085
15.61239304
-
D-Galactose
Galactose
ME284985
-
C00124
14.74611183
-
3-beta-D-Galactosyl-sn-glycerol
Galactosylglycerol
ME284911
-
C05401
13.71491024
-
D-Galacturonate
Galacturonic acid
ME284863
-
C00333
14.29222431
-
GDP-L-fucose
GDP-L-fucose
ME284886
-
C00325
17.24783338
-
GDP-mannose
GDP-mannose
ME284895
-
C00096
17.8726024
-
Glu-Asp
Glu-Asp
ME284972
-
-
13.88384127
-
D-Glucarate
Glucaric acid
ME284973
-
C00818
16.70194107
-
D-Gluconic acid
Gluconic acid
ME284866
-
C00257
13.3296106
-
D-Glucono-1,5-lactone
Gluconolactone
ME284884
-
C00198
11.82056169
-
alpha-D-Glucosamine 1-phosphate
Glucosamine 1-phosphate
ME284896
-
C06156
15.41645472
-
D-Glucose
Glucose
ME284941
-
C00221
12.64083715
-
D-Glucose 1-phosphate
Glucose 1-phosphate
ME284846
-
C00103
14.98764181
-
D-Glucose 6-phosphate
Glucose 6-phosphate
ME284774
-
C00092
16.5430085
-
Glu-Ser-Thr
Glu-Ser-Thr
ME284987
-
-
14.66402668
-
L-Glutamate
Glutamic acid
ME284904
-
C00025
14.52403502
-
D-Glycerate
Glyceric acid
ME284830
-
C00258
11.71263921
-
Gly-Ser
Gly-Ser
ME284853
-
-
12.84881046
-
[FA (16:4)] hexadecatetraenoic acid
Hexadecatetraenoic acid
ME284744
-
-
4.256809768
-
FA(16:1)
Hexadecenoic acid
ME284749
-
C08362
4.000294578
-
Hippurate
Hippuric acid
ME284802
-
C01586
8.242796178
-
Hydantoin-5-propionate
Hydantoin-5-propionic acid
ME284827
-
C05565
15.23608559
-
Hydroxymethylphosphonate
Hydroxymethylphosphonic acid
ME284797
-
C06455
14.32765943
-
4-Hydroxyphenylacetylglycine
Hydroxyphenylacetylglycine
ME284772
-
C05596
7.637813355
-
3-(4-Hydroxyphenyl)lactate
Hydroxyphenyllactic acid
ME284960
-
C03672
8.831691865
-
IMP
IMP
ME284917
-
C00130
15.25353489
-
Indoxylsulfate
Indoxyl sulfate
ME284762
-
-
7.647591718
-
D-myo-Inositol 1,4,5-trisphosphate
Inositol 1,4,5-trisphosphate
ME284870
-
C01245
18.47899773
-
ITP
ITP
ME284850
-
C00081
17.44944598
-
Dodecanoic acid
Lauric acid
ME284740
-
C02679
4.138296822
-
FA methyl(12:0) dodecanoic acid
Lauric acid
ME284795
-
-
4.094069832
-
L-Fuculose 1-phosphate
L-Fuculose 1-phosphate
ME284943
-
C01099
15.17793062
-
FA(24:0)
Lignoceric acid
ME284794
-
-
3.827188245
-
Linoleate
Linoleic acid
ME284739
-
C01595
3.958935582
-
LysoPA(16:0)
LPA 16:0
ME284814
-
-
4.841868267
-
LysoPA(18:0)
LPA 18:0
ME284899
-
-
4.726916098
-
LysoPE(22:6)
LPE 22:6
ME284825
-
-
4.626391672
-
(S)-Malate
Malic acid
ME284775
-
C00149
15.72568507
-
Mannitol
Mannitol
ME284919
-
C00392
13.90088058
-
D-Mannitol 1-phosphate
Mannitol 1-phosphate
ME284909
-
C00644
14.99757447
-
alpha-D-Mannoheptulopyranose
Manno-heptulose
ME284929
-
C08236
13.68663301
-
D-Mannonate
Mannonic acid
ME284984
-
C00514
13.92807545
-
FA (17:0)
Margaric acid
ME284788
-
-
3.95545378
-
Melibiitol
Melibiitol
ME284858
-
C05399
15.52934006
-
Mesaconate
Mesaconic acid
ME284914
-
C01732
11.80807044
-
[FA] Methyl jasmonate
Methyl jasmonate
ME284800
-
C11512
4.401349063
-
(S)-2-Amino-3-(3-hydroxy-4-oxo-4H-pyridin-1-yl)pro...
Mimosine
ME284926
-
C04771
14.15749886
-
Monoglyceride citrate
Monoglyceride citrate
ME284938
-
-
11.58943627
-
Tetradecanoic acid
Myristic acid
ME284747
-
C06424
4.054904297
-
N-Acetyl-L-aspartate
N-Acetylaspartic acid
ME284848
-
C01042
14.36088434
-
N-Acetyl-D-fucosamine
N-Acetyl-D-fucosamine
ME284859
-
C15480
11.21243211
-
N-Acetyl-D-glucosamine 1,6-bisphosphate
N-Acetylglucosamine 1,6-bisphosphate
ME284808
-
C04461
16.60484107
-
N-Acetyl-D-glucosamine 6-phosphate
N-Acetyl-glucosamine 6-phosphate
ME284979
-
C00357
14.65548108
-
N-acetyl -D- glucosaminitol
N-Acetyl-glucosaminitol
ME284959
-
-
13.28140913
-
N-Acetylornithine
N-Acetylornithine
ME284786
-
C00437
13.49308435
-
2-O-alpha-L-Rhamnopyranosyl-D-glucopyranose
Neohesperidose
ME284769
-
C08244
15.95196272
-
N-Ethylglycocyamine
N-Ethylglycocyamine
ME284977
-
C02852
13.35506963
-
N-Glycolyl-D-glucosamine
N-Glycolyl-D-glucosamine
ME284883
-
C03146
12.92686377
-
N-Hydroxy-L-tyrosine
N-Hydroxy-tyrosine
ME284841
-
C03004
10.33928742
-
Nicotinurate
Nicotinuric acid
ME284928
-
C05380
14.15212943
-
N,N'-Dimethylurea
N,N-Dimethylurea
ME284804
-
C16364
14.15777593
-
FA (19:1)
Nonadecenoic acid
ME284767
-
-
3.942764493
-
nonulose 9-phosphate
Nonulose 9-phosphate
ME284880
-
-
16.58581498
-
N-Undecylbenzenesulfonic acid
N-Undecylbenzenesulfonic acid
ME284989
-
-
3.825435992
-
octulose 8-phosphate
Octulose 8-phosphate
ME284874
-
-
16.26721844
-
[FA (18:1)] 9Z-octadecenoic acid
Oleic acid
ME284757
-
C00712
3.942102035
-
Orotate(Fragment)
Orotic acid
ME284936
-
C00295
12.11104556
-
Orotidine
Orotidine
ME284944
-
-
12.13403467
-
PA(18:1(9Z)/0:0)
PA 18:1(9Z)/0:0
ME284815
-
C00416
4.814119837
-
PA(34:1)
PA 34:1
ME284824
-
-
3.794063963
-
PA(34:2)
PA 34:2
ME284792
-
-
3.79387804
-
PA(36:1)
PA 36:1
ME284888
-
-
3.762134975
-
PA(36:2)
PA 36:2
ME284855
-
C00416
3.795297403
-
PA(36:3)
PA 36:3
ME284832
-
-
3.77727473
-
PA(36:4)
PA 36:4
ME284820
-
-
3.777829498
-
FA(16:0)
Palmitic acid
ME284753
-
-
4.016006233
-
PE(12:0/18:4(6Z,9Z,12Z,15Z))
PE 12:0/18:4(6Z,9Z,12Z,15Z)*
ME284988
-
-
4.988908725
-
PE(31:4)
PE 31:4
ME284963
-
-
7.655770787
-
PE(34:1)
PE 34:1
ME284940
-
-
4.028643983
-
PE(34:2)
PE 34:2
ME284931
-
-
4.026689822
-
PE(36:1)
PE 36:1
ME284974
-
-
4.000141552
-
PE(36:2)
PE 36:2
ME284826
-
C00350
3.995229972
-
PE(P-40:4)
PE P-40:4
ME284849
-
-
3.960117752
-
PE(P-40:7)
PE P-40:7
ME284869
-
-
3.928867723
-
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)*
ME284799
-
-
7.640465322
-
PG(34:1)
PG 34:1
ME284937
-
-
3.823801688
-
PG(34:2)
PG 34:2
ME284784
-
-
3.685241742
-
PG(36:2)
PG 36:2
ME284828
-
-
3.77823662
-
PG(36:3)
PG 36:3
ME284803
-
-
3.673761795
-
Phenolsulfonphthalein
Phenolsulfonphthalein
ME284882
-
C12600
5.110569558
-
Phosphonoacetate
Phosphonoacetate
ME284868
-
C05682
15.36447185
-
Orthophosphate
Phosphoric acid
ME284930
-
C00009
15.69561691
-
Phytuberin
Phytuberin
ME284923
-
C09709
4.109530672
-
PI(36:1)
PI 36:1
ME284873
-
-
3.804377252
-
PI(36:2)
PI 36:2
ME284872
-
-
3.799596052
-
PI(36:4)
PI 36:4
ME284790
-
-
3.804218128
-
PI(38:4)
PI 38:4
ME284839
-
-
3.78698612
-
PI(38:5)
PI 38:5
ME284791
-
-
3.78940113
-
PIP(38:4)
PI P-38:4
ME284991
-
C00626
7.65636586
-
PS(18:0)
PS 18:0
ME284992
-
-
4.314925757
-
PS(34:1)
PS 34:1
ME284879
-
-
3.816010688
-
PS(36:1)
PS 36:1
ME284836
-
-
3.798665343
-
PS(36:2)
PS 36:2
ME284798
-
-
3.797960262
-
PS(36:3)
PS 36:3
ME284782
-
-
3.796548765
-
PS(36:4)
PS 36:4
ME284793
-
-
3.79645935
-
PS(38:4)
PS 38:4
ME284811
-
-
3.777294042
-
PS(38:5)
PS 38:5
ME284807
-
-
3.781534785
-
PS(38:6)
PS 38:6
ME284780
-
-
3.781855857
-
PS(39:4)
PS 39:4
ME284837
-
-
3.77247894
-
PS(40:8)
PS 40:8
ME284763
-
-
3.774513512
-
PS(42:10)
PS 42:10
ME284831
-
-
3.759044367
-
Psychosine
Psychosine
ME284806
-
C01747
4.739486625
-
Pyrazinemethanethiol
Pyrazinemethanethiol
ME284898
-
-
14.72547569
-
5-Oxoproline
Pyroglutamic acid
ME284913
-
C01879
10.15812405
-
PQQ
Pyrroloquinoline quinone
ME284756
-
C00113
15.50423699
-
Quinate
Quinic acid
ME284968
-
C00296
12.55266362
-
D-4'-Phosphopantothenate
(R)-4'-Phosphopantothenic acid
ME284743
-
C03492
14.89827429
-
L-Rhamnose
Rhamnose
ME284953
-
C00507
11.55229629
-
D-Ribose 1,5-bisphosphate
Ribose 1,5-bisphosphate
ME284796
-
C01151
17.29895593
-
D-Ribose 5-phosphate
Ribose 5-phosphate
ME284892
-
C00117
15.37840099
-
D-Sedoheptulose 1,7-bisphosphate
Sedoheptulose 1,7-bisphosphate
ME284770
-
C00447
17.90499548
-
sn-Glycerol 3-phosphate
sn-Glycero-3-phosphate
ME284865
-
C00093
14.80111973
-
sn-glycero-3-Phospho-1-inositol
sn-Glycero-3-phosphoinositol
ME284949
-
C01225
15.90255464
-
[SP] Sphing-4-enine-1-phosphate
Sphingosine 1-phosphate
ME284912
-
C06124
5.016756812
-
Octadecanoic acid
Stearic acid
ME284776
-
C01530
3.98889273
-
Succinate
Succinic acid
ME284889
-
C00042
14.85422861
-
Succinate semialdehyde
Succinic acid semialdehyde
ME284907
-
C00232
13.5676955
-
Succinyladenosine
Succinyladenosine
ME284742
-
-
14.29241285
-
Sucrose
Sucrose
ME284908
-
C00089
15.08650448
-
Sulfate
Sulfate
ME284860
-
C00059
17.54126282
-
(R,R)-Tartaric acid
Tartaric acid
ME284948
-
C00898
16.94568943
-
Taurine
Taurine
ME284900
-
C00245
14.72847273
-
Tributyrin
TG 4:0/4:0/4:0
ME284783
-
C13870
4.30473425
-
UDP-glucose
UDP-glucose
ME284887
-
C00029
16.04600595
-
UDP-glucuronate
UDP-glucuronic acid
ME284867
-
C00167
18.58490548
-
UDP-N-acetyl-D-galactosamine
UDP-N-acetylgalactosamine
ME284945
-
C00203
14.85840647
-
[FA (11:0)] undecanoic acid
Undecylic acid
ME284852
-
-
4.210409715
-
Urate
Uric acid
ME284971
-
C00366
12.44024028
-
UTP
UTP
ME284905
-
C00075
17.30561825
-
vanillylamine
Vanillylamine
ME284966
-
C16666
7.634401025
-
1,9S,11R,15S-tetrahydroxy-13E-prostaene
-
ME284764
-
-
3.910972458
-
2-C-Methyl-D-erythritol 4-phosphate
-
ME284969
-
C11434
14.00704819
-
3-(ADP)-2-phosphoglycerate
-
ME284918
-
C03673
17.26202817
-
3-(ADP)-glycerate
-
ME284875
-
C02509
16.20468064
-
3-Deoxy-D-manno-octulosonate 8-phosphate
-
ME284829
-
C04478
15.05235253
-
3-O-(6'-O-(13Z,16Z,19Z-docosatrienoyl)-beta-D-gluc...
-
ME284809
-
-
6.551115608
-
3-phosphoglucarate
-
ME284822
-
-
18.65096712
-
3-Phosphonopyruvate
-
ME284885
-
C02798
12.65941014
-
Ala-Cys-Pro-Ser
-
ME284964
-
-
14.6326223
-
Ala-Met-Asp-Tyr
-
ME284819
-
-
10.26619466
-
Arg-Phe-Phe-Arg
-
ME284986
-
-
14.7614813
-
Avenic acid A
-
ME284975
-
-
15.42648091
-
Bile salt
-
ME284933
-
C01558
5.01561373
-
Cyclic 2,3-bisphospho-D-glycerate
-
ME284954
-
C06189
19.66147405
-
Cys-Gly-Pro-Ser
-
ME284845
-
-
14.75706576
-
Cys-Leu-Cys-Tyr
-
ME284903
-
-
10.27442848
-
D-1-[(3-Carboxypropyl)amino]-1-deoxyfructose
-
ME284980
-
-
11.06142894
-
D-erythro-L-galacto-Nonulose
-
ME284924
-
-
16.55459783
-
D-glycero-L-galacto-Octulose
-
ME284916
-
-
14.20087771
-
(E)-3,7-Dimethylocta-1,6-diene-3,8-diol
-
ME284821
-
C04433
4.280770632
-
FA hydroxy(10:0)
-
ME284812
-
-
4.561973608
-
FA hydroxy(16:0)] hexadecanoic acid
-
ME284760
-
-
4.139920237
-
FA hydroxy(18:0)
-
ME284745
-
-
4.071562468
-
FA methyl(14:0)
-
ME284761
-
C16665
4.01691574
-
FA methyl(16:1)
-
ME284801
-
-
4.0033186
-
FA methyl(18:0)
-
ME284864
-
-
3.913241093
-
FA methyl(6:0)
-
ME284862
-
-
4.803119313
-
FA methyl(8:0)
-
ME284787
-
-
4.415392412
-
FA methyl (8:1)
-
ME284901
-
-
4.542638537
-
FA oxo(16:0)
-
ME284754
-
-
4.059345605
-
FA oxo(18:0)
-
ME284746
-
-
3.9976045
-
GalNAcbeta1-3Galalpha1-4Galbeta1-4Glcbeta-Cer(d18:...
-
ME284978
-
-
4.983873372
-
Gln-Leu-Lys-Tyr
-
ME284976
-
-
15.58051148
-
Glu-Lys-Lys-Phe
-
ME284993
-
-
15.92930186
-
HEPES
-
ME284920
-
-
10.46597885
-
hydrogen iodide
-
ME284922
-
C05590
9.942528187
-
L-Ala-L-Glu
-
ME284906
-
-
10.05318064
-
melibionate
-
ME284957
-
-
15.02541586
-
Miroestrol
-
ME284840
-
C08831
14.49497399
-
N3-fumaramoyl-L-2,3-diaminopropanoate
-
ME284894
-
-
15.4059499
-
N-Butyl-beta-carboline-3-carboxylate
-
ME284778
-
C13805
4.873222873
-
nicotinamide guanine dinucleotide
-
ME284994
-
-
13.0005807
-
P-DPD
-
ME284951
-
-
12.48536815
-
PIPES
-
ME284990
-
-
14.06201623
-
Sulforaphane
-
ME284844
-
-
7.617120492
-
tartrazine
-
ME284958
-
-
16.61196229
-
UCSD Metabolomics Workbench, a resource sponsored by the Common Fund of the National Institutes of Health
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