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Analysis: ESI positive ion mode
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
NICOTINAMIDE ADENINE DINUCLEOTIDE
NAD
ME659542
10897651
C00003
-
-
PHOSPHATE
Phosphoric acid
ME659453
1004
C00009
-
-
URIDINE 5`-DIPHOSPHATE
UDP
ME659555
6031
C00015
-
-
FLAVIN ADENINE DINUCLEOTIDE
FAD
ME659323
643975
C00016
-
-
S-ADENOSYL METHIONINE
S-Adenosylmethionine
ME659482
34755
C00019
-
-
ADENOSINE 5`-MONOPHOSPHATE
AMP
ME659212
6083
C00020
-
-
ADENOSINE 5`-MONOPHOSPHATE (*)
AMP
ME659213
6083
C00020
-
-
S-ADENOSYL-L-HOMOCYSTEINE
S-Adenosylhomocysteine
ME659483
439155
C00021
-
-
ALPHA-KETO-GLUTARATE
2-Oxoglutaric acid
ME659216
51
C00026
-
-
GUANOSINE 5`-DIPHOSPHATE
GDP
ME659345
8977
C00035
-
-
GLYCINE
Glycine
ME659340
750
C00037
-
-
SUCCINATE (*)
Succinic acid
ME659504
1110
C00042
-
-
GLUTATHIONE
Glutathione
ME659336
124886
C00051
-
-
ASCORBATE
Vitamin C
ME659225
54670067
C00072
-
-
PHOSPHO(ENOL)PYRUVIC ACID
Phosphoenolpyruvic acid
ME659546
1005
C00074
-
-
TYROSINE (*)
Tyrosine
ME659521
6057
C00082
-
-
UREA
Urea
ME659553
1176
C00086
-
-
GLUCOSE-6-PHOSPHATE
Glucose 6-phosphate
ME659534
5958
C00092
-
-
INOSINE 5`-DIPHOSPHATE
IDP
ME659367
6831
C00104
-
-
ANTHRANILATE
2-Aminobenzoic acid
ME659222
227
C00108
-
-
RIBOSE 5-PHOSPHATE
Ribose 5-phosphate
ME659480
439167
C00117
-
-
BIOTIN
Biotin
ME659234
171548
C00120
-
-
INOSINE 5`-MONOPHOSPHATE
IMP
ME659368
8582
C00130
-
-
HISTIDINE (*)
Histidine
ME659352
6274
C00135
-
-
NICOTINAMIDE
Niacinamide
ME659423
936
C00153
-
-
CITRATE
Citric acid
ME659263
311
C00158
-
-
HEXOSE (*)
Hexose
ME659349
206
C00159
-
-
ACETOACETATE
Acetoacetic acid
ME659530
96
C00164
-
-
DIPALMITOYLGLYCEROL (*)
DG 16:0_16:0
ME659305
644078
C00165
-
-
PHENYLPYRUVATE
Phenylpyruvic acid
ME659545
997
C00166
-
-
5`-METHYLTHIOADENOSINE
5'-Methylthioadenosine
ME659206
439176
C00170
-
-
VALINE (*)
Valine
ME659559
6287
C00183
-
-
ETHANOLAMINE
Ethanolamine
ME659318
700
C00189
-
-
D-GLUCONO-1,5-LACTONE
Gluconolactone
ME659280
7027
C00198
-
-
ADENOSINE
Adenosine
ME659210
60961
C00212
-
-
THYMIDINE
Thymidine
ME659510
5789
C00214
-
-
3,4-DIHYDROXYBENZOATE
Protocatechuic acid
ME659166
72
C00230
-
-
4-METHYL-2-OXOPENTANOATE
Ketoleucine
ME659194
70
C00233
-
-
GUANINE
Guanine
ME659343
764
C00242
-
-
TAURINE
Taurine
ME659505
1123
C00245
-
-
ALPHA-LIPOAMIDE
Lipoamide
ME659217
863
C00248
-
-
PYRIDOXAL
Pyridoxal
ME659469
1050
C00250
-
-
RIBOFLAVIN
Riboflavin
ME659479
493570
C00255
-
-
GLYCERIC ACID
Glyceric acid
ME659338
439194
C00258
-
-
HYPOXANTHINE
Hypoxanthine
ME659360
790
C00262
-
-
HOMOSERINE
Homoserine
ME659354
12647
C00263
-
-
6,7-DIHYDROBIOPTERIN
4a-Carbinolamine tetrahydrobiopterin
ME659207
133246
C00268
-
-
MANNOSE-6-PHOSPHATE
Mannose 6-phosphate
ME659540
439198
C00275
-
-
EDTA
Edetic acid
ME659310
6049
C00284
-
-
EDTA (*)
Edetic acid
ME659311
6049
C00284
-
-
ANILINE
Aniline
ME659221
6115
C00292
-
-
INOSINE
Inosine
ME659366
6021
C00294
-
-
QUINATE
Quinic acid
ME659473
6508
C00296
-
-
URIDINE
Uridine
ME659554
6029
C00299
-
-
CREATINE
Creatine
ME659270
586
C00300
-
-
GLUTAMIC ACID
Glutamic acid
ME659332
33032
C00302
-
-
GLUTAMINE
Glutamine
ME659333
5961
C00303
-
-
BRADYKININ (*)
Bradykinin
ME659247
439201
C00306
-
-
BRADYKININ DES-ARG(9) (*)
Bradykinin
ME659248
439201
C00306
-
-
BRADYKININ HYDROXY-PRO(3) (*)
Bradykinin
ME659249
439201
C00306
-
-
CYTIDINE 5`-DIPHOSPHOCHOLINE
CDP-choline
ME659278
13804
C00307
-
-
ISOCITRIC ACID
Isocitric acid
ME659369
1198
C00311
-
-
PYRIDOXINE
Pyridoxine
ME659471
1054
C00314
-
-
SPERMIDINE
Spermidine
ME659492
1102
C00315
-
-
CITRULLINE
Citrulline
ME659264
9750
C00327
-
-
2`-DEOXYGUANOSINE
Deoxyguanosine
ME659164
187790
C00330
-
-
DIHYDROOROTATE
4,5-Dihydroorotic acid
ME659296
648
C00337
-
-
PHOSPHOETHANOLAMINE
Phosphoethanolamine
ME659547
1015
C00346
-
-
GLUCOSAMINE 6-PHOSPHATE
Glucosamine 6-phosphate
ME659331
439217
C00352
-
-
3,4-DIHYDROXY-L-PHENYLALANINE
DOPA
ME659165
6047
C00355
-
-
2`-DEOXYGUANOSINE 5`-DIPHOSPHATE
dGDP
ME659522
439220
C00361
-
-
URATE
Uric acid
ME659550
1175
C00366
-
-
URATE (*)
Uric acid
ME659551
1175
C00366
-
-
RETINAL
Retinal
ME659476
638015
C00376
-
-
CYTOSINE
Cytosine
ME659279
597
C00380
-
-
XANTHINE
Xanthine
ME659562
1188
C00385
-
-
CARNOSINE
Carnosine
ME659255
439224
C00386
-
-
GUANOSINE
Guanosine
ME659344
6802
C00387
-
-
TRYPTAMINE
Tryptamine
ME659516
1150
C00398
-
-
PIPECOLIC ACID
Pipecolic acid
ME659458
849
C00408
-
-
PROGESTERONE
Progesterone
ME659463
5994
C00410
-
-
DIHYDROFOLATE
Dihydrofolic acid
ME659295
98792
C00415
-
-
CIS-ACONITATE
cis-Aconitic acid
ME659261
643757
C00417
-
-
5-AMINOLEVULINIC ACID
5-Amino-levulinic acid
ME659198
137
C00430
-
-
ESTRONE
Estrone
ME659317
5870
C00468
-
-
RETINOL
Retinol
ME659478
445354
C00473
-
-
CYTIDINE
Cytidine
ME659277
6175
C00475
-
-
GLUTARATE
Glutaric acid
ME659334
743
C00489
-
-
ITACONATE
Itaconic acid
ME659539
811
C00490
-
-
RAFFINOSE
Raffinose
ME659475
439242
C00492
-
-
SHIKIMATE
Shikimic acid
ME659489
8742
C00493
-
-
BILIVERDIN
Biliverdin
ME659232
5280353
C00500
-
-
ERYTHRITOL
Erythritol
ME659315
222285
C00503
-
-
FOLIC ACID
Folic acid
ME659324
6037
C00504
-
-
HYDROQUINONE
Hydroquinone
ME659357
785
C00530
-
-
PYRIDOXAMINE
Pyridoxamine
ME659470
1052
C00534
-
-
TESTOSTERONE
Testosterone
ME659506
6013
C00535
-
-
HOMOGENTISATE
Homogentisic acid
ME659353
780
C00544
-
-
SPHINGOMYELIN
SM 18:1;O2/18:0
ME659495
53481362
C00550
-
-
SPHINGOMYELIN (CATION)
SM 18:0;O2/22:1
ME659496
53481362
C00550
-
-
STEAROYL SPHINGOMYELIN (*)
SM 18:1;O2/18:0
ME659500
6453725
C00550
-
-
2`-DEOXYADENOSINE
Deoxyadenosine
ME659162
13730
C00559
-
-
TRIMETHYLAMINE
Trimethylamine
ME659515
1146
C00565
-
-
4-AMINOBENZOATE
p-Aminobenzoic acid
ME659186
978
C00568
-
-
ADENOSINE 3`,5`-CYCLIC MONOPHOSPHATE
3',5' cyclic AMP
ME659211
6076
C00575
-
-
2-DEOXY-D-GLUCOSE
2-Deoxy-glucose
ME659154
439268
C00586
-
-
PHOSPHOCHOLINE
Choline phosphate
ME659454
135437
C00588
-
-
3-HYDROXYANTHRANILATE
3-Hydroxyanthranilic acid
ME659177
86
C00632
-
-
4-HYDROXYBENZALDEHYDE
4-Hydroxybenzaldehyde
ME659193
126
C00633
-
-
INDOLE-3-ACETALDEHYDE
Indoleacetaldehyde
ME659361
800
C00637
-
-
LL-2,6-DIAMINOHEPTANEDIOATE
2,6-Diaminopimelic acid
ME659378
1549100
C00666
-
-
GLYCEROPHOSPHORYLCHOLINE (*)
sn-Glycero-3-phosphocholine
ME659339
657272
C00670
-
-
SN-GLYCERO-3-PHOSPHOCHOLINE
sn-Glycero-3-phosphocholine
ME659490
657272
C00670
-
-
CHOLIC ACID
Cholic acid
ME659256
221493
C00695
-
-
MALATE
Malic acid
ME659381
222656
C00711
-
-
PTERIN
Pterin
ME659467
73000
C00715
-
-
BETAINE
Betaine
ME659231
247
C00719
-
-
CORTISOL
Cortisol
ME659266
5754
C00735
-
-
CYSTEINE
Cysteine
ME659275
594
C00736
-
-
SPERMINE
Spermine
ME659493
1103
C00750
-
-
SQUALENE
Squalene
ME659497
5280370
C00751
-
-
CORTISONE
Cortisone
ME659268
222786
C00762
-
-
HISTIDINE
Histidine
ME659351
6274
C00768
-
-
RETINOATE
Retinoic acid
ME659477
444795
C00777
-
-
SEROTONIN
Serotonin
ME659488
5202
C00780
-
-
UROCANATE
Urocanic acid
ME659556
1549103
C00785
-
-
EPINEPHRINE
Epinephrine
ME659314
5816
C00788
-
-
CREATININE
Creatinine
ME659271
588
C00791
-
-
CREATININE FROM COMPLEX
Creatinine
ME659272
588
C00791
-
-
SALICYLIC ACID
Salicylic acid
ME659485
338
C00805
-
-
TRYPTOPHAN
Tryptophan
ME659517
6305
C00806
-
-
4-COUMARATE
cis-p-Coumaric acid
ME659188
637542
C00811
-
-
CITRAMALATE
Citramalic acid
ME659262
1081
C00815
-
-
GLUCARIC/GULARIC/SACCHARIC ACID
Glucaric acid
ME659532
607
C00818
-
-
OXOMALONATE
Mesoxalic acid
ME659434
10132
C00830
-
-
SPHINGANINE
Sphinganine
ME659494
91486
C00836
-
-
4-PYRIDOXATE
4-Pyridoxic acid
ME659197
6723
C00847
-
-
PANTOTHENIC ACID
Pantothenic acid
ME659442
988
C00864
-
-
2`-DEOXYCYTIDINE
Deoxycytidine
ME659163
13711
C00881
-
-
3`-DEPHOSPHO COA
3'-Dephospho-CoA
ME659184
444485
C00882
-
-
INDOLE-3-ACETIC ACID
Indoleacetic acid
ME659363
802
C00954
-
-
INDOLE-3-ETHANOL
Tryptophanol
ME659364
10685
C00955
-
-
TRYPTOPHANAMIDE
Tryptophanamide
ME659519
439356
C00977
-
-
N-ACETYLSEROTONIN
N-Acetylserotonin
ME659411
903
C00978
-
-
TRIGONELLINE
Trigonelline
ME659514
5570
C01004
-
-
PANTOLACTONE
Pantolactone
ME659441
439368
C01012
-
-
5-HYDROXY-L-TRYPTOPHAN
5-Hydroxy-tryptophan
ME659199
439280
C01017
-
-
4-GUANIDINOBUTANOIC ACID
4-Guanidinobutanoic acid
ME659189
500
C01035
-
-
CYCLOHEXANE-1,3-DIONE
Cyclohexane-1,3-dione
ME659274
10434
C01066
-
-
N-ACETYL-D-GALACTOSAMINE
N-Acetylgalactosamine
ME659399
35717
C01132
-
-
N(PAI)-METHYL-L-HISTIDINE
3-Methylhistidine
ME659397
64969
C01152
-
-
BISPHOSPHOGLYCERATE
2,3-Diphosphoglyceric acid
ME659236
186004
C01159
-
-
3,4-DIHYDROXYPHENYLACETATE
3,4-Dihydroxybenzeneacetic acid
ME659167
547
C01161
-
-
17ALPHA-HYDROXYPROGESTERONE
17alpha-Hydroxyprogesterone
ME659151
6238
C01176
-
-
3-(4-HYDROXYPHENYL)PYRUVATE
4-Hydroxyphenylpyruvic acid
ME659170
979
C01179
-
-
3-(2-HYDROXYPHENYL)PROPANOATE
3-(2-Hydroxyphenyl)propanoic acid
ME659168
873
C01198
-
-
HEXOSE
Hexose
ME659348
206
C01381
-
-
ALANINE
Alanine
ME659214
5950
C01401
-
-
BENZOIN
Benzoin
ME659230
8400
C01408
-
-
BOC-ASN
-
ME659239
82035
C01410
-
-
CYSTINE
Cystine
ME659276
595
C01420
-
-
FERULATE
trans-Ferulic acid
ME659322
445858
C01494
-
-
TYROSINE
Tyrosine
ME659520
6057
C01536
-
-
ALLANTOIN
Allantoin
ME659215
204
C01551
-
-
HIPPURATE
Hippuric acid
ME659350
464
C01586
-
-
MELATONIN
Melatonin
ME659382
896
C01598
-
-
ORNITHINE
Ornithine
ME659433
6262
C01602
-
-
PHTHALATE
Phthalic acid
ME659456
1017
C01606
-
-
STACHYOSE
Stachyose
ME659498
439531
C01613
-
-
CADAVERINE
Cadaverine
ME659252
273
C01672
-
-
KYNURENIC ACID
Kynurenic acid
ME659371
3845
C01717
-
-
KYNURENINE
Kynurenine
ME659372
161166
C01718
-
-
LUMICHROME
Lumichrome
ME659379
5326566
C01727
-
-
METHIONINE
Methionine
ME659383
6137
C01733
-
-
XANTHOSINE
Xanthosine
ME659563
64959
C01762
-
-
DEOXYRIBOSE
Deoxyribose
ME659284
9828112
C01801
-
-
HOMOCYSTINE
Homocystine
ME659536
10010
C01817
-
-
THYROXINE
Thyroxine
ME659511
5819
C01829
-
-
5-OXO-PROLINE
Pyroglutamic acid
ME659203
499
C01879
-
-
DETHIOBIOTIN
Dethiobiotin
ME659285
445027
C01909
-
-
GLYCOCHOLATE
Glycocholic acid
ME659341
10140
C01921
-
-
PREGNENOLONE
Pregnenolone
ME659461
8955
C01953
-
-
2-HYDROXYPHENYLACETIC ACID
2-Hydroxyphenylacetic acid
ME659157
11914
C01983
-
-
PHENYLALANINE
Phenylalanine
ME659451
6140
C02057
-
-
CORTICOSTERONE
Corticosterone
ME659265
5753
C02140
-
-
METHYLMALONATE
Methylmalonic acid
ME659391
487
C02170
-
-
2-METHYLMALEATE
Citraconic acid
ME659159
643798
C02226
-
-
4-NITROCATECHOL
4-Nitrocatechol
ME659527
3505109
C02235
-
-
5-VALEROLACTONE
5-Valerolactone
ME659204
10953
C02240
-
-
METHYLGUANIDINE
Methylguanidine
ME659390
10111
C02294
-
-
N-ETHYLMALEIMIDE
N-Ethylmaleimide
ME659418
4362
C02441
-
-
3,3`,5-TRIIODO-L-THYRONINE
Liothyronine
ME659523
5920
C02465
-
-
XANTHURENIC ACID
Xanthurenic acid
ME659564
5699
C02470
-
-
ALPHA-TOCOPHEROL
alpha-Tocopherol
ME659218
14985
C02477
-
-
1-METHYLADENOSINE
1-Methyladenosine
ME659146
27476
C02494
-
-
ESTRADIOL 17 ALPHA
Estradiol-17alpha
ME659316
68570
C02537
-
-
O-ACETYL-L-CARNITINE
CAR 2:0
ME659425
1
C02571
-
-
3-DEHYDROCARNITINE
3-Dehydrocarnitine
ME659173
6991982
C02636
-
-
3-DEHYDROSHIKIMATE
3-Dehydroshikimate
ME659174
439774
C02637
-
-
PIMELIC ACID
Pimelic acid
ME659457
385
C02656
-
-
INDOLE-3-ACETAMIDE
1H-Indole-3-acetamide
ME659362
397
C02693
-
-
N-ACETYL-L-LEUCINE
N-Acetylleucine
ME659407
75619
C02710
-
-
N-ACETYLPUTRESCINE
N-Acetylputrescine
ME659410
122356
C02714
-
-
PHENYLETHANOLAMINE
2-Hydroxyphenethylamine
ME659452
1000
C02735
-
-
10-HYDROXYDECANOATE
10-Hydroxydecanoic acid
ME659148
74300
C02774
-
-
3,4-DICHLOROANILINE
3,4-Dichloroaniline
ME659525
7257
C02791
-
-
3-HYDROXY-DL-KYNURENINE
Hydroxykynurenine
ME659176
89
C02794
-
-
5-HYDROXYPENTANOIC ACID
5-Hydroxyvaleric acid
ME659202
25945
C02804
-
-
ACENAPHTHENEQUINONE
Acenaphthenequinone
ME659529
6724
C02807
-
-
CORTISOL 21-ACETATE
Cortisol 21-acetate
ME659267
5744
C02821
-
-
OCTANOYLCARNITINE (*)
CAR 8:0
ME659428
123701
C02838
-
-
S-HEXYL-GLUTATHIONE
S-Hexyl-glutathione
ME659484
97536
C02886
-
-
4-ACETAMIDOBUTANOATE
4-Acetamidobutanoic acid
ME659185
18189
C02946
-
-
PALMITOYLCARNITINE (*)
CAR 16:0
ME659439
11953816
C02990
-
-
PROPIONYLCARNITINE (*)
CAR 3:0
ME659466
188824
C03017
-
-
2,6-DIHYDROXYPYRIDINE
2,6-Dihydroxypyridine
ME659152
69371
C03056
-
-
5-HYDROXYMETHYLURACIL
5-Hydroxymethyluracil
ME659201
78168
C03088
-
-
DIMETHYLBENZIMIDAZOLE
Dimethylbenzimidazole
ME659300
675
C03114
-
-
N-ACETYL-D-TRYPTOPHAN
N-Acetyl-D-tryptophan
ME659401
439917
C03137
-
-
FORMYL-L-METHIONINE
N-Formylmethionine
ME659325
6995182
C03145
-
-
4-NITROPHENYL PHOSPHATE
4-Nitrophenyl phosphate
ME659196
378
C03360
-
-
N-ACETYL-L-PHENYLALANINE
N-Acetylphenylalanine
ME659408
74839
C03519
-
-
THIOPURINE S-METHYLETHER
6-Methylthiopurine
ME659508
5778
C03542
-
-
DIMETHYLARGININE (*)
Dimethylarginine
ME659299
123831
C03626
-
-
2`,4`-DIHYDROXYACETOPHENONE
2',4'-Dihydroxyacetophenone
ME659161
6990
C03663
-
-
3-(4-HYDROXYPHENYL)LACTATE
Hydroxyphenyllactic acid
ME659169
9378
C03672
-
-
BIS(2-ETHYLHEXYL)PHTHALATE
Bis(2-ethylhexyl)phthalate
ME659235
8343
C03690
-
-
N-BENZYLOXYCARBONYLGLYCINE
N-Benzyloxycarbonylglycine
ME659414
14349
C03710
-
-
PYRIDINE-2,3-DICARBOXYLATE
Quinolinic acid
ME659549
1066
C03722
-
-
TRANS-CYCLOHEXANE-1,2-DIOL
trans-Cyclohexane-1,2-diol
ME659513
92886
C03739
-
-
3-HYDROXY-3-METHYLGLUTARATE
3-Hydroxymethylglutaric acid
ME659175
1662
C03761
-
-
N,N,N-TRIMETHYLLYSINE
N-6-Trimethyllysine
ME659398
440120
C03793
-
-
PIPERINE (*)
Piperine
ME659459
638024
C03882
-
-
OLEOYLGLYCEROPHOSPHOCHOLINE (*)
LPC 18:1
ME659431
5280634
C03916
-
-
3ALPHA-HYDROXY-5BETA-CHOLANATE
Lithocholic acid
ME659182
9903
C03990
-
-
N6-(DELTA2-ISOPENTENYL)-ADENINE
N6-Isopentenyladenine
ME659422
92180
C04083
-
-
PALMITOYLGLYCEROPHOSPHOCHOLINE (*)
LPC 16:0
ME659440
460602
C04102
-
-
HEPTADECANOYLGLYCEROPHOSPHOCHOLINE (*)
LPC 17:0
ME659347
53480465
C04230
-
-
MYRISTOYLGLYCEROPHOSPHOCHOLINE (*)
LPC 14:0
ME659396
460604
C04230
-
-
NICOTINAMIDE HYPOXANTHINE DINUCLEOTIDE
Nicotinamide purin-6-ol-dinucleotide
ME659543
440334
C04423
-
-
DEOXYCHOLATE
Deoxycholic acid
ME659282
222528
C04483
-
-
5-AMINOIMIDAZOLE-4-CARBOXAMIDE-1-BETA-D-RIBOFURANO...
AICAR
ME659528
65110
C04677
-
-
LEUCENOL
Mimosine
ME659374
440473
C04771
-
-
5`-DEOXYADENOSINE
5'-Deoxyadenosine
ME659205
439182
C05198
-
-
ARACHIDONOYLGLYCEROPHOSPHOCHOLINE (*)
LPC 20:4
ME659223
-
C05208
-
-
11-BETA-HYDROXYANDROST-4-ENE-3,17-DIONE
11beta-Hydroxyandrost-4-ene-3,17-dione
ME659149
94141
C05284
-
-
PHENETHYLAMINE
Phenylethylamine
ME659448
1001
C05332
-
-
GULONO-1,4-LACTONE
D-Gulonolactone
ME659346
165105
C05410
-
-
VITAMIN D2
Vitamin D2
ME659560
5280793
C05441
-
-
VITAMIN D3
Vitamin D3
ME659561
10883523
C05443
-
-
HOMOVANILLATE
Homovanillic acid
ME659356
1738
C05582
-
-
4-HYDROXY-3-METHOXYMANDELIC
Vanillylmandelic acid
ME659190
736172
C05584
-
-
4-HYDROXY-3-METHOXYMANDELIC ACID
-
ME659191
736172
C05584
-
-
3-METHOXYTYRAMINE
3-Methoxytyramine
ME659179
1669
C05587
-
-
PHENYLACETYLGLUTAMINE (*)
alpha-N-Phenylacetylglutamine
ME659450
92258
C05597
-
-
5-HYDROXYINDOLE-3-ACETIC ACID
5-Hydroxyindoleacetic acid
ME659200
1826
C05635
-
-
INDOXYL
Indoxyl
ME659365
50591
C05658
-
-
PHOSPHONOACETATE
Phosphonoacetate
ME659455
546
C05682
-
-
N1-METHYL-2-PYRIDONE-5-CARBOXAMIDE (*)
N1-Methyl-2-pyridone-5-carboxamide
ME659420
69698
C05842
-
-
2-HYDROXYBUTYRIC ACID
2-Hydroxybutyric acid
ME659156
11266
C05984
-
-
BIOPTERIN
Biopterin
ME659233
445040
C06313
-
-
2-QUINOLINECARBOXYLIC ACID
Quinaldic acid
ME659160
7124
C06325
-
-
QUINOLIN-2-OL
2-Hydroxyquinoline
ME659474
6038
C06338
-
-
DOCOSAHEXAENOIC ACID
Docosahexaenoic acid
ME659306
445580
C06429
-
-
4-METHYLCATECHOL
4-Methylcatechol
ME659195
9958
C06730
-
-
DIETHANOLAMINE
Diethanolamine
ME659292
8113
C06772
-
-
PHENYLACETIC ACID
Phenylacetic acid
ME659449
999
C07086
-
-
THEOPHYLLINE
Theophylline
ME659507
2153
C07130
-
-
PENICILLAMINE
Penicillamine
ME659444
4727
C07418
-
-
CAFFEINE
Caffeine
ME659253
2519
C07481
-
-
7-AMINOCEPHALOSPORANIC ACID
7-Aminocephalosporanic acid
ME659209
441328
C07756
-
-
URSODIOL
Ursodeoxycholic acid
ME659557
31401
C07880
-
-
AZELAIC ACID
Azelaic acid
ME659228
2266
C08261
-
-
SUBERIC ACID
Suberic acid
ME659503
10457
C08278
-
-
HOMOSTACHYDRINE (*)
(S)-Homostachydrine
ME659355
441447
C08283
-
-
12-HYDROXY-DODECANOIC ACID
12-Hydroxy lauric acid
ME659150
79034
C08317
-
-
TRYPTOPHAN BETAINE (*)
Lenticin
ME659518
442106
C09213
-
-
SALSOLINOL
Salsolinol
ME659486
54456
C09642
-
-
ROSMARINIC ACID
Rosmarinic acid
ME659481
5281792
C10489
-
-
METHYL JASMONATE
Methyl jasmonate
ME659387
5281929
C11512
-
-
N-CYCLOHEXYLFORMAMIDE
N-Cyclohexylformamide
ME659416
13017
C11519
-
-
CYCLOHEX-1-ENECARBOXYLIC ACID
Cyclohex-1-enecarboxylic acid
ME659273
69470
C12101
-
-
CAPECITABINE
Capecitabine
ME659254
60953
C12650
-
-
NICOTINIC ACID ADENINE DINUCLEOTIDE PHOSPHATE
NAADP
ME659544
123953
C13051
-
-
STEARAMIDE (*)
Stearamide
ME659499
31292
C13846
-
-
DEOXYCORTICOSTERONE
Deoxy-corticosterone
ME659283
6166
C14554
-
-
METHYLXANTHINE (*)
Methylxanthine
ME659392
68374
C16353
-
-
ASPARTATE
Aspartic acid
ME659227
5960
C16433
-
-
ISOLEUCINE
Isoleucine
ME659538
6306
C16434
-
-
PROLINE
Proline
ME659464
145742
C16435
-
-
VALINE
Valine
ME659558
6287
C16436
-
-
ASPARAGINE
Asparagine
ME659226
6267
C16438
-
-
LEUCINE
Leucine
ME659375
6106
C16439
-
-
LYSINE
Lysine
ME659380
5962
C16440
-
-
MONO-METHYL GLUTARATE
Monomethyl glutaric acid
ME659395
73917
CA1015
-
-
ENKEPHALINE, (D-ALA)2-LEU
-
ME659313
-
CA1037
-
-
MEVALOLACTONE
Mevalolactone
ME659393
-
CA1091
-
-
2-METHYLGLUTARIC ACID
2-Methylglutaric acid
ME659158
12046
CA1107
-
-
N-ACETYL-L-ASPARTIC ACID
N-Acetylaspartic acid
ME659405
65065
CA1200
-
-
BOC-GLY-OH
-
ME659241
-
CA1201
-
-
3-UREIDOPROPIONIC ACID
Ureidopropionic acid
ME659181
111
CA1202
-
-
O-PHOSPHO-DL-SERINE
DL-O-Phosphoserine
ME659426
106
CA1209
-
-
N-ACETYL-DL-METHIONINE
N-Acetylmethionine
ME659403
448580
CA1210
-
-
N-ACETYLGLYCINE
N-Acetylglycine
ME659409
10972
CA1212
-
-
ETHYL 3-INDOLE ACETATE
Ethyl 3-indoleacetate
ME659319
-
CA1213
-
-
N-ALPHA-ACETYL-L-ASPARAGINE
N-Acetylasparagine
ME659412
-
CA1214
-
-
N-ALPHA-ACETYL-L-LYSINE
N(2)-Acetyllysine
ME659413
92907
CA1219
-
-
OLEAMIDE
Oleamide
ME659429
5283387
CA1223
-
-
METHYL INDOLE-3-ACETATE
Indole-3-methyl acetate
ME659386
74706
CA1231
-
-
3BETA-HYDROXY-5ALPHA-PREGNAN-20-ONE
3beta-Hydroxy-5alpha-pregnan-20-one
ME659183
92787
CA1234
-
-
3-ALPHA,11-BETA,17-ALPHA,21-TETRAHYDROXY- 5-ALPHA-...
Tetrahydrocortisol
ME659172
5864
CA1235
-
-
DI-TERT-BUTYL DICARBONATE
Tert-butoxycarbonyl anhydride
ME659288
90495
CA1253
-
-
CIS-7,10,13,16-DOCOSATETRAENOIC ACID
Adrenic acid
ME659260
5497181
CA1260
-
-
METHYL ACETOACETATE
Methylacetoacetic acid
ME659385
7757
CA1265
-
-
N-FORMYLGLYCINE
N-Formylglycine
ME659541
75606
CA1268
-
-
PROMETRYN
Prometryn
ME659465
4929
CA1277
-
-
P-BENZOQUINONE
Quinone
ME659435
4650
CA1285
-
-
DIMETHYL MALEATE
Dimethyl maleate
ME659298
12215
CA1310
-
-
3-METHYL-2-OXINDOLE
3-Methyloxindole
ME659180
150923
CA1325
-
-
N-CYCLOHEXYLSULFAMIC ACID
Cyclamic acid
ME659417
7533
CA1328
-
-
BOC-ALA (+NA)
-
ME659237
-
CA1333
-
-
BOC-ALA-OH
-
ME659238
-
CA1333
-
-
BOC-PHE-OH
-
ME659244
-
CA1334
-
-
BOC-PRO-OH
-
ME659245
-
CA1335
-
-
BOC-HIS-OH
-
ME659242
-
CA1336
-
-
ETHYL 4-OXOCYCLOHEXANECARBOXYLATE
Ethyl 4-oxocyclohexanecarboxylate
ME659320
317638
CA1342
-
-
GLYCOLITHOCHOLIC ACID ETHYL ESTER
-
ME659342
-
CA1349
-
-
BOC-ASP-OH
-
ME659240
-
CA1350
-
-
METHYL PARABEN
Methylparaben
ME659388
7456
CA1357
-
-
3-METHOXY-L-TYROSINE
3-Methoxytyrosine
ME659178
9307
CA1364
-
-
ETHYLMALONIC ACID
Ethylmalonic acid
ME659321
11756
CA1366
-
-
1-OLEOYL-RAC-GLYCEROL
MG 18:1
ME659147
5319879
CA1373
-
-
1,2-DIDECANOYL-SN-GLYCERO-3-PHOSPHOCHOLINE
PC 10:0/10:0
ME659145
-
CA1375
-
-
NORMETANEPHRINE
Normetanephrine
ME659424
1237
CA1379
-
-
THREONINE (*)
Threonine
ME659509
6288
CA1381
-
-
URDINE 5`-DIPHOSPHO-N-ACETYLGALACTOSAMINE
-
ME659552
-
CA1401
-
-
GLYCERALDEHYDE 3-PHOSPHATE DIETHYL ACETAL
Glyceraldehyde 3-phosphate diethyl acetal
ME659337
-
CA1402
-
-
SELENOCYSTAMINE
Selenocystamine
ME659487
-
CA1403
-
-
6-HYDROXYDOPAMINE
6-Hydroxydopamine
ME659208
4624
CA1404
-
-
LAUROYLCARNITINE
CAR 12:0
ME659373
10427569
CA1406
-
-
4-HYDROXY-3-METHOXYPHENYLGLYCOL
Vanylglycol
ME659192
10805
CA1410
-
-
SORBIC ACID
Sorbic acid
ME659491
643460
CA1411
-
-
MONO-ETHYL MALONATE
Monoethyl malonic acid
ME659394
70615
CA1417
-
-
BOC-A-(1-NAPHTHYLMETHYL)-DL-PRO-OH
-
ME659531
-
CA1419
-
-
GAMMA-BUTYROLACTONE
gamma-Butyrolactone
ME659326
7302
CA1420
-
-
GLUCOSAMINE 6-SULFATE
Glucosamine 6-sulfate
ME659533
72361
CA1422
-
-
BOC-SER-OH
-
ME659246
-
CA1423
-
-
BOC-LYS-OH
-
ME659243
-
CA1424
-
-
N-BOC-D-GLUCOSAMINE
Glucosamine
ME659415
-
CA1426
-
-
N-ACETYL-DL-GLUTAMIC ACID
N-Acetylglutamic acid
ME659402
70914
CA1454
-
-
P-BROMO-DL-PHENYLALANINE
P-Bromo-DL-phenylalanine
ME659436
85681
CA1463
-
-
OPHTHALMIC ACID
Ophthalmic acid
ME659432
7018721
CA1475
-
-
PARAOXON-METHYL
Paraoxon-methyl
ME659443
13708
CA1476
-
-
N-NITROSODIETHANOLAMINE
N-Nitrosodiethanolamine
ME659419
14223
CA1477
-
-
2-HYDROXY-4-(METHYLTHIO)BUTYRIC ACID
2-Hydroxy-4-(methylthio)butanoic acid
ME659155
11427
CA1484
-
-
DIETHYL AMINOMALONATE
Diethyl aminomalonate
ME659293
81272
CA1488
-
-
3,3`-DITHIODIVALINE
3,3'-Dithiodivaline
ME659524
258527
CA1489
-
-
4-AMINOBENZOYLGLUTAMIC ACID
4-Aminobenzoylglutamic acid
ME659187
65138
CA1491
-
-
PENTOPYRANOSE
Pentopyranose
ME659447
641630
CA1493
-
-
O-PHOSPHONOHEXOPYRANOSE
-
ME659427
-
CA1494
-
-
DIHEXOSE
-
ME659294
-
CA1495
-
-
PHOSPHOGLYCERIC ACID
Phosphoglyceric acid
ME659548
724
CA1497
-
-
N-ACETYL-D-HEXOSAMINE
N-Acetylhexosamine
ME659400
-
CA1500
-
-
HEXURONIC ACID
Hexuronic acid
ME659535
152867
CA1503
-
-
2-AMINO-2-DEOXYHEXOPYRANOSE
-
ME659153
-
CA1504
-
-
DIMETHYLXANTHINE
-
ME659302
-
CA1507
-
-
DIMETHYLXANTHINE (*)
-
ME659303
-
CA1507
-
-
AMINOHYDROXYBUTANOIC ACID
-
ME659220
-
CA1508
-
-
PYRIDINE CARBOXYLIC ACID
-
ME659468
-
CA1509
-
-
PENTITOL
Arabitol
ME659446
827
CA1511
-
-
HYDROXYPHENYLACETIC / MANDELIC ACID
2-Hydroxyphenylacetic acid
ME659537
11914
CA1513
-
-
AMINOHYDROXYBENZOIC ACID
Aminohydroxybenzoic acid
ME659219
-
CA1514
-
-
DIHYDROXYBENZOIC ACID
Dihydroxybenzoic acid
ME659297
-
CA1515
-
-
HYDROXYBENZALDEHYDE
Hydroxybenzaldehyde
ME659358
6998
CA1516
-
-
HYDROXYBENZOIC ACID
Hydroxybenzoic acid
ME659359
135
CA1517
-
-
BENZENEDICARBOXYLIC ACID
-
ME659229
-
CA1518
-
-
[13C]-LYSINE
Lysine
ME659570
5962
CA1684
-
-
[13C]-ARGININE
Arginine
ME659565
6322
CA1719
-
-
[13C]-THREONINE
Threonine
ME659574
6288
CA1727
-
-
[13C]-GLUTAMATE
Glutamic acid
ME659567
-
CA1731
-
-
[13C]-ASPARTIC ACID
Aspartic acid
ME659566
5960
CA1745
-
-
[13C]-PROLINE
Proline
ME659573
145742
CA1754
-
-
[13C]-VALINE
Valine
ME659576
6287
CA1779
-
-
[13C]-METHIONINE
Methionine
ME659571
6137
CA1790
-
-
[13C]-TYROSINE
Tyrosine
ME659575
6057
CA1825
-
-
[13C]-ISOLEUCINE
Isoleucine
ME659568
6306
CA1831
-
-
[13C]-LEUCINE
Leucine
ME659569
6106
CA1831
-
-
[13C]-PHENYLALANINE
Phenylalanine
ME659572
6140
CA1855
-
-
ARG-VAL-TRP
Arg-Val-Trp
ME659224
-
CA1890
-
-
N-ACETYL-L-CYSTEINE
N-Acetylcysteine
ME659406
12035
CE1310
-
-
N-ACETYL-L-ALANINE
N-Acetylalanine
ME659404
88064
CE1554
-
-
3,5-DIIODO-L-THYRONINE
3,5-Diiodothyronine
ME659526
123675
CE6369
-
-
DIACYLGLYCEROPHOSPHOGLYCEROL (*)
-
ME659291
-
K00037
-
-
DOCOSAHEXAENOYLGLYCEROPHOSPHOETHANOLAMINE (*)
-
ME659308
-
K01455
-
-
PYROGLUTAMINE (*)
Pyroglutamine
ME659472
134508
K01750
-
-
LINOLEOYLGLYCEROPHOSPHOCHOLINE (*)
LPC 18:2
ME659377
-
K02239
-
-
BUTYRYLCARNITINE (*)
CAR 4:0
ME659250
213144
K07954
-
-
TIGLYL CARNITINE (*)
CAR 4:1;2Me
ME659512
22833596
K08128
-
-
STEAROYLCARNITINE (*)
CAR 18:0
ME659501
52922056
K08129
-
-
ISOVALERYLCARNITINE (*)
CAR 4:0;3Me
ME659370
6426851
K08149
-
-
PENTADECANOYLGLYCEROPHOSPHOCHOLINE/STEAROYLGLYCERO...
-
ME659445
-
K08217
-
-
DOCOSAPENTAENOYLGLYCEROPHOSPHOCHOLINE
LPC 22:5
ME659309
-
K08312
-
-
STEAROYLGLYCEROPHOSPHOCHOLINE (*)
LPC 18:0
ME659502
-
K08377
-
-
EICOSATRIENOYLGLYCEROPHOSPHOCHOLINE (*)
-
ME659312
-
K08397
-
-
GAMMA-GLUTAMYLMETHIONINE (*)
gamma-Glutamylmethionine
ME659328
-
K08579
-
-
PALMITOYL SPHINGOMYELIN (*)
SM 18:1;O2/16:0
ME659438
9939941
K08639
-
-
GAMMA-GLUTAMYLPHENYLALANINE (*)
gamma-Glutamylphenylalanine
ME659329
111299
K08879
-
-
GLUTAROYL CARNITINE (*)
CAR DC5:0
ME659335
53481622
K09042
-
-
PALMITOLEOYLGLYCEROPHOSPHOCHOLINE (*)
LPC 16:1
ME659437
-
K09130
-
-
DIMETHYLGUANOSINE (*)
Dimethylguanosine
ME659301
-
K09146
-
-
CIS-4-DECENOYL CARNITINE (*)
CAR 10:1
ME659259
57357170
K09179
-
-
GAMMA-GLUTAMYLISOLEUCINE (*)
gamma-Glutamylisoleucine
ME659327
14253342
K09236
-
-
DOCOSAHEXAENOYLGLYCEROPHOSPHOCHOLINE (*)
LPE 22:6
ME659307
-
K09469
-
-
3-(CYSTEIN-S-YL)ACETAMINOPHEN (*)
3-(Cystein-S-yl)acetaminophen
ME659171
-
K10359
-
-
CINNAMOYLGLYCINE (*)
Cinnamoylglycine
ME659258
709625
K10610
-
-
DECANOYLCARNITINE (*)
CAR 10:0
ME659281
11953821
K10936
-
-
COTININE (*)
Cotinine
ME659269
408
K10998
-
-
METHYLGLUTAROYLCARNITINE (*)
CAR DC5:0;3Me
ME659389
-
K11239
-
-
N4-ACETYLCYTIDINE (*)
N4-Acetylcytidine
ME659421
107461
K11647
-
-
METHIONYLALANINE (*)
Met-Ala
ME659384
7009581
K13270
-
-
GAMMA-GLUTAMYLTYROSINE (*)
gamma-Glutamyltyrosine
ME659330
94340
K14770
-
-
C-GLYCOSYLTRYPTOPHAN (*)
C-Glycosyltryptophan
ME659251
-
K87470
-
-
LEUCYLPHENYLALANINE (*)
Leu-Phe
ME659376
6992310
K87920
-
-
CINNAMOYLGLYCINE (*)
Cinnamoylglycine
ME659257
-
K88537
-
-
OLEOYLCARNITINE (*)
CAR 18:1
ME659430
6441392
K88838
-
-
PRO-HYDROXY-PRO (*)
Pro-hydroxyPro
ME659462
11902892
K96372
-
-
POSSIBLE L-LEUCYL-L-LEUCINE
-
ME659460
-
U03237
-
-
DI-LINOLEOYL-3-SN-PHOSPHATIDYLCHOLINE (POSSIBLY)
-
ME659286
-
UP0002
-
-
DIACYL-PHOSPHATIDYLCHOLINE
-
ME659290
-
UP0012
-
-
DI-LINOLEOYL-3-SN-PHOSPHATIDYLCHOLINE (PROBABLY)
-
ME659287
-
UP0013
-
-
DIACYL-GLYCEROPHOSPHOCHOLINE (C50H82NO8P PROBABLY)
-
ME659289
-
UP0027
-
-
DIOLEOYLPHOSPHATIDYLCHOLINE
PC 18:1/18:1
ME659304
-
Z02138
-
-
Analysis: ESI negative ion mode
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
ADENOSINE 5`-TRIPHOSPHATE
ATP
ME659956
5957
C00002
-
-
NICOTINAMIDE ADENINE DINUCLEOTIDE
NAD
ME659969
10897651
C00003
-
-
NADP
NADP
ME659838
5886
C00006
-
-
ADENOSINE 5`-DIPHOSPHATE
ADP
ME659654
6022
C00008
-
-
PHOSPHATE
Phosphoric acid
ME659871
1004
C00009
-
-
URIDINE 5`-DIPHOSPHATE
UDP
ME659933
6031
C00015
-
-
FLAVIN ADENINE DINUCLEOTIDE
FAD
ME659747
643975
C00016
-
-
ADENOSINE 5`-MONOPHOSPHATE
AMP
ME659655
6083
C00020
-
-
S-ADENOSYL-L-HOMOCYSTEINE
S-Adenosylhomocysteine
ME659896
439155
C00021
-
-
PYRUVATE
Pyruvic acid
ME659889
1060
C00022
-
-
URIDINE 5`-DIPHOSPHOGLUCOSE
UDP-glucose
ME659934
53477679
C00029
-
-
GUANOSINE 5`-DIPHOSPHATE
GDP
ME659768
8977
C00035
-
-
SUCCINATE
Succinic acid
ME659910
1110
C00042
-
-
URIDINE 5`-DIPHOSPHO-N-ACETYLGLUCOSAMINE
UDP-N-acetylglucosamine
ME659974
445675
C00043
-
-
GUANOSINE 5`-TRIPHOSPHATE
GTP
ME659769
6830
C00044
-
-
GLYOXYLATE
Glyoxylic acid
ME659764
760
C00048
-
-
CYTIDINE 5`-MONOPHOSPHATE
CMP
ME659959
6131
C00055
-
-
CYTIDINE 5`-TRIPHOSPHATE
CTP
ME659718
6176
C00063
-
-
THIAMINE PYROPHOSPHATE
Thiamine diphosphate
ME659918
1132
C00068
-
-
PHOSPHO(ENOL)PYRUVIC ACID
Phosphoenolpyruvic acid
ME659872
1005
C00074
-
-
URIDINE 5`-TRIPHOSPHATE
UTP
ME659935
6133
C00075
-
-
TRYPTOPHAN (*)
Tryptophan
ME659927
6305
C00078
-
-
INOSINE 5`-TRIPHOSPHATE
ITP
ME659793
8583
C00081
-
-
CATECHOL
Pyrocatechol
ME659695
289
C00090
-
-
GUANOSINE 5`-DIPHOSPHO-D-MANNOSE
GDP-mannose
ME659965
18396
C00096
-
-
INOSINE 5`-DIPHOSPHATE
IDP
ME659792
6831
C00104
-
-
URACIL
Uracil
ME659930
1174
C00106
-
-
ANTHRANILATE
2-Aminobenzoic acid
ME659666
227
C00108
-
-
2-OXOBUTANOATE
3-Methyl pyruvic acid
ME659949
58
C00109
-
-
DIHYDROXYACETONE PHOSPHATE
Dihydroxyacetone phosphate
ME659730
668
C00111
-
-
CYTIDINE 5`-DIPHOSPHATE
CDP
ME659716
6132
C00112
-
-
RIBOSE 5-PHOSPHATE
Ribose 5-phosphate
ME659894
439167
C00117
-
-
5-PHOSPHO-ALPHA-D-RIBOSE
Phosphoribosyl pyrophosphate
ME659643
7339
C00119
-
-
BIOTIN
Biotin
ME659680
171548
C00120
-
-
FUMARIC ACID
Fumaric acid
ME659749
444972
C00122
-
-
GLUTATHIONE OXIDIZED
Glutathione
ME659963
975
C00127
-
-
2`-DEOXYADENOSINE 5`-TRIPHOSPHATE
dATP
ME659950
15993
C00131
-
-
MYO-INOSITOL
Myo-inositol
ME659814
892
C00137
-
-
GUANOSINE 5` MONOPHOSPHATE
GMP
ME659767
6804
C00144
-
-
ADENINE
Adenine
ME659651
190
C00147
-
-
NICOTINAMIDE
Niacinamide
ME659840
936
C00153
-
-
CITRATE
Citric acid
ME659705
311
C00158
-
-
PHENYLPYRUVATE
Phenylpyruvic acid
ME659870
997
C00166
-
-
URIDINE 5`-DIPHOSPHOGLUCURONIC ACID
UDP-glucuronic acid
ME659975
17473
C00167
-
-
5`-METHYLTHIOADENOSINE
5'-Methylthioadenosine
ME659644
439176
C00170
-
-
NONADECENOATE (*)
Nonadecenoic acid
ME659843
-
C00174
-
-
THYMINE
Thymine
ME659922
1135
C00178
-
-
BENZOATE
Benzoic acid
ME659677
243
C00180
-
-
LACTATE (*)
Lactic acid
ME659796
107689
C00186
-
-
(S)-LACTATE
Lactic acid
ME659578
107689
C00186
-
-
CHOLESTEROL (*)
Cholesterol
ME659698
5997
C00187
-
-
2`-DEOXYADENOSINE 5`-DIPHOSPHATE
dADP
ME659596
188966
C00206
-
-
OXALATE
Oxalic acid
ME659856
971
C00209
-
-
ADENOSINE
Adenosine
ME659652
60961
C00212
-
-
THYMIDINE
Thymidine
ME659921
5789
C00214
-
-
ARACHIDONATE
Arachidonic acid
ME659668
444899
C00219
-
-
3,4-DIHYDROXYBENZOATE
Protocatechuic acid
ME659601
72
C00230
-
-
2`-DEOXYCYTIDINE 5`-MONOPHOSPHATE
dCMP
ME659599
13945
C00239
-
-
TAURINE
Taurine
ME659912
1123
C00245
-
-
LIPOAMIDE
Lipoamide
ME659803
863
C00248
-
-
PALMITIC ACID
Palmitic acid
ME659860
985
C00249
-
-
PYRIDOXAL
Pyridoxal
ME659887
1050
C00250
-
-
RIBOFLAVIN
Riboflavin
ME659893
493570
C00255
-
-
GLYCERIC ACID
Glyceric acid
ME659758
439194
C00258
-
-
HYPOXANTHINE
Hypoxanthine
ME659786
790
C00262
-
-
N-ACETYLNEURAMINATE
N-Acetylneuraminic acid
ME659828
439197
C00270
-
-
EDTA (*)
Edetic acid
ME659740
6049
C00284
-
-
ETHYLENEDIAMINETETRAACETIC (EDTA) ACID
Edetic acid
ME659745
6049
C00284
-
-
INOSINE
Inosine
ME659791
6021
C00294
-
-
OROTATE
Orotic acid
ME659855
967
C00295
-
-
QUINATE
Quinic acid
ME659890
6508
C00296
-
-
URIDINE
Uridine
ME659932
6029
C00299
-
-
CREATINE
Creatine
ME659709
586
C00300
-
-
ADP-RIBOSE
ADP-ribose
ME659958
192
C00301
-
-
GLUTAMIC ACID
Glutamic acid
ME659755
33032
C00302
-
-
GLUTAMINE
Glutamine
ME659756
5961
C00303
-
-
CYTIDINE 5`-DIPHOSPHOCHOLINE
CDP-choline
ME659717
13804
C00307
-
-
PYRIDOXINE
Pyridoxine
ME659888
1054
C00314
-
-
2-OXOADIPATE
Oxoadipic acid
ME659592
71
C00322
-
-
CITRULLINE
Citrulline
ME659706
9750
C00327
-
-
(S)-DIHYDROOROTATE
4,5-Dihydroorotic acid
ME659577
648
C00337
-
-
6-PHOSPHOGLUCONIC ACID
6-Phosphogluconic acid
ME659647
91493
C00345
-
-
PHOSPHOETHANOLAMINE
Phosphoethanolamine
ME659874
1015
C00346
-
-
GLUCOSAMINE 6-PHOSPHATE
Glucosamine 6-phosphate
ME659753
439217
C00352
-
-
GERANYL PYROPHOSPHATE
Geranyl diphosphate
ME659751
447277
C00353
-
-
2`-DEOXYURIDINE 5`-MONOPHOSPHATE
dUMP
ME659951
65063
C00365
-
-
URATE
Uric acid
ME659931
1175
C00366
-
-
MALONATE
Malonic acid
ME659807
867
C00383
-
-
XANTHINE
Xanthine
ME659939
1188
C00385
-
-
CARNOSINE
Carnosine
ME659694
439224
C00386
-
-
GUANOSINE
Guanosine
ME659766
6802
C00387
-
-
ISOLEUCINE/LEUCINE (*)
Leucine/Isoleucine
ME659794
6306
C00407
-
-
PROGESTERONE
Progesterone
ME659881
5994
C00410
-
-
DIHYDROFOLATE
Dihydrofolic acid
ME659960
98792
C00415
-
-
ACONITATE (*)
trans-Aconitic acid
ME659650
444212
C00417
-
-
5,6-DIHYDROURACIL
Dihydrouracil
ME659636
649
C00429
-
-
5-AMINOLEVULINIC ACID
5-Amino-levulinic acid
ME659638
137
C00430
-
-
2`-DEOXYURIDINE 5`-TRIPHOSPHATE
UTP
ME659600
6133
C00460
-
-
PURINE
Purine
ME659884
1044
C00465
-
-
ESTRONE
Estrone
ME659744
5870
C00468
-
-
TYRAMINE
Tyramine
ME659929
5610
C00483
-
-
GLUTARATE
Glutaric acid
ME659757
743
C00489
-
-
RAFFINOSE
Raffinose
ME659891
439242
C00492
-
-
SHIKIMATE
Shikimic acid
ME659904
8742
C00493
-
-
ADENOSINE-5`-DIPHOSPHOGLUCOSE
ADP-glucose
ME659957
16500
C00498
-
-
BILIVERDIN
Biliverdin
ME659679
5280353
C00500
-
-
XYLONATE (*)
Xylonic acid
ME659943
6602431
C00502
-
-
ERYTHRITOL
Erythritol
ME659742
222285
C00503
-
-
FOLIC ACID
Folic acid
ME659961
6037
C00504
-
-
CYSTEIC ACID
Cysteic acid
ME659713
72886
C00506
-
-
ORNITHINE
Ornithine
ME659854
6262
C00515
-
-
HYPOTAURINE
Hypotaurine
ME659785
107812
C00519
-
-
PANTOATE
(R)-Pantoic acid
ME659864
439251
C00522
-
-
DEOXYURIDINE
Deoxyuridine
ME659723
13712
C00526
-
-
TESTOSTERONE
Testosterone
ME659916
6013
C00535
-
-
CYSTATHIONINE
Cystathionine
ME659712
439258
C00542
-
-
HOMOGENTISATE
Homogentisic acid
ME659966
780
C00544
-
-
2`-DEOXYADENOSINE
Deoxyadenosine
ME659595
13730
C00559
-
-
4-AMINOBENZOATE
p-Aminobenzoic acid
ME659622
978
C00568
-
-
ADENOSINE 3`,5`-CYCLIC MONOPHOSPHATE
3',5' cyclic AMP
ME659653
6076
C00575
-
-
GUANIDINOACETATE
Guanidoacetic acid
ME659765
763
C00581
-
-
CHOLINE PHOSPHATE
Choline phosphate
ME659700
135437
C00588
-
-
PHENYLACETALDEHYDE
Phenylacetaldehyde
ME659867
998
C00601
-
-
3-SULFINO-L-ALANINE
3-Sulfino-alanine
ME659618
1549098
C00606
-
-
3-HYDROXYANTHRANILATE
3-Hydroxyanthranilic acid
ME659610
86
C00632
-
-
4-HYDROXYBENZALDEHYDE
4-Hydroxybenzaldehyde
ME659631
126
C00633
-
-
4-HYDROXYPHENYLACETATE
4-Hydroxyphenyl acetate
ME659632
127
C00642
-
-
5-HYDROXY-L-TRYPTOPHAN
5-Hydroxy-tryptophan
ME659639
439280
C00643
-
-
XANTHOSINE 5`-MONOPHOSPHATE
XMP
ME659941
73323
C00655
-
-
LL-2,6-DIAMINOHEPTANEDIOATE
2,6-Diaminopimelic acid
ME659804
1549100
C00666
-
-
SN-GLYCERO-3-PHOSPHOCHOLINE
sn-Glycero-3-phosphocholine
ME659905
657272
C00670
-
-
CHOLATE
Cholic acid
ME659697
221493
C00695
-
-
2`-DEOXYCYTIDINE 5`-DIPHOSPHATE
dCDP
ME659598
150855
C00705
-
-
MALATE
Malic acid
ME659806
222656
C00711
-
-
OLEATE
Oleic acid
ME659851
445639
C00712
-
-
SERINE
Serine
ME659903
5951
C00716
-
-
[C13] VALINE
Valine
ME659947
6287
C00719
-
-
RETINOATE
Retinoic acid
ME659892
444795
C00777
-
-
UROCANATE
Urocanic acid
ME659936
1549103
C00785
-
-
SALICYLATE (*)
Salicylic acid
ME659900
338
C00805
-
-
4-COUMARATE
cis-p-Coumaric acid
ME659624
637542
C00811
-
-
OXOMALONATE
Mesoxalic acid
ME659857
10132
C00830
-
-
4-PYRIDOXATE
4-Pyridoxic acid
ME659634
6723
C00847
-
-
PANTOTHENIC ACID
Pantothenic acid
ME659865
988
C00864
-
-
4-NITROPHENOL
4-Nitrophenol
ME659633
980
C00870
-
-
2`-DEOXYCYTIDINE
Deoxycytidine
ME659597
13711
C00881
-
-
ESTRADIOL-17BETA
beta-Estradiol
ME659743
5757
C00951
-
-
INDOLE-3-ACETIC ACID
Indoleacetic acid
ME659788
802
C00954
-
-
INDOLE-3-ETHANOL
Tryptophanol
ME659789
10685
C00955
-
-
MERCAPTOPYRUVATE
3-Mercaptopyruvic acid
ME659809
98
C00957
-
-
TRYPTOPHANAMIDE
Tryptophanamide
ME659928
439356
C00977
-
-
N-ACETYLSEROTONIN
N-Acetylserotonin
ME659829
903
C00978
-
-
6-HYDROXYNICOTINATE
6-Hydroxynicotinic acid
ME659646
72924
C01020
-
-
4-GUANIDINOBUTANOIC ACID
4-Guanidinobutanoic acid
ME659625
500
C01035
-
-
THIAMIN MONOPHOSPHATE
Thiamine monophosphate
ME659917
3382778
C01081
-
-
3-HYDROXYBUTANOIC ACID
3-Hydroxybutyric acid
ME659613
441
C01089
-
-
O-SUCCINYL-L-HOMOSERINE
o-Succinylhomoserine
ME659848
439406
C01118
-
-
N-ACETYL-D-GALACTOSAMINE
N-Acetylgalactosamine
ME659819
35717
C01132
-
-
N(PAI)-METHYL-L-HISTIDINE
3-Methylhistidine
ME659817
64969
C01152
-
-
N(PAI)-METHYL-L-HISTIDINE (*)
3-Methylhistidine
ME659818
64969
C01152
-
-
2,3-DIPHOSPHO-D-GLYCERIC ACID
2,3-Diphosphoglyceric acid
ME659585
186004
C01159
-
-
17ALPHA-HYDROXYPROGESTERONE
17alpha-Hydroxyprogesterone
ME659582
6238
C01176
-
-
RIBULOSE 1,5-BISPHOSPHATE
Ribulose 1,5-bisphosphate
ME659972
123658
C01182
-
-
3-(2-HYDROXYPHENYL)PROPANOATE
3-(2-Hydroxyphenyl)propanoic acid
ME659604
873
C01198
-
-
PHYTIC ACID
Myo-inositol hexakisphosphate
ME659878
890
C01204
-
-
1-AMINOCYCLOPROPANE-1-CARBOXYLATE
1-Aminocyclopropanecarboxylic acid
ME659580
535
C01234
-
-
B-ALANYL-N(PAI)-METHYL-L-HISTIDINE
Anserine
ME659675
112072
C01262
-
-
BENZOIN
Benzoin
ME659678
8400
C01408
-
-
BOC-ASN-OH
-
ME659685
82035
C01410
-
-
CYS-GLY
Cys-Gly
ME659711
439498
C01419
-
-
CYSTINE
Cystine
ME659714
595
C01420
-
-
FERULATE
trans-Ferulic acid
ME659746
445858
C01494
-
-
STEARATE
Stearic acid
ME659907
5281
C01530
-
-
TARTARIC ACID
Tartaric acid
ME659911
444305
C01534
-
-
[C13] TYROSINE
Tyrosine
ME659946
6057
C01536
-
-
ALLANTOIN
Allantoin
ME659658
204
C01551
-
-
DECANOATE
Capric acid
ME659719
2969
C01571
-
-
HEXANOATE
Caproic acid
ME659776
8892
C01585
-
-
HIPPURATE
Hippuric acid
ME659779
464
C01586
-
-
LINOLEATE
Linoleic acid
ME659801
5280450
C01595
-
-
MELATONIN
Melatonin
ME659808
896
C01598
-
-
NONANOATE
Pelargonic acid
ME659844
8158
C01601
-
-
PHTHALATE
Phthalic acid
ME659877
1017
C01606
-
-
STACHYOSE
Stachyose
ME659906
439531
C01613
-
-
THREONATE (*)
Threonic acid
ME659920
151152
C01620
-
-
4-HYDROXY-2-QUINOLINECARBOXYLIC ACID
Kynurenic acid
ME659626
3845
C01717
-
-
KYNURENINE
Kynurenine
ME659795
161166
C01718
-
-
LUMICHROME
Lumichrome
ME659805
5326566
C01727
-
-
[C13] METHIONINE
Methionine
ME659944
6137
C01733
-
-
METHIONINE
Methionine
ME659810
6137
C01733
-
-
XANTHOSINE
Xanthosine
ME659940
64959
C01762
-
-
ALDOSTERONE
Aldosterone
ME659657
5839
C01780
-
-
DEOXYRIBOSE
Deoxyribose
ME659722
9828112
C01801
-
-
THYROXINE
Thyroxine
ME659924
5819
C01829
-
-
5-OXO-PROLINE
Pyroglutamic acid
ME659642
499
C01879
-
-
DETHIOBIOTIN
Dethiobiotin
ME659725
445027
C01909
-
-
GLYCOCHOLATE
Glycocholic acid
ME659761
10140
C01921
-
-
PREGNENOLONE
Pregnenolone
ME659880
8955
C01953
-
-
2-HYDROXYPHENYLACETIC ACID
2-Hydroxyphenylacetic acid
ME659589
11914
C01983
-
-
2-AMINOPHENOL
2-Aminophenol
ME659587
5801
C01987
-
-
[C13] PHENYLALANINE
Phenylalanine
ME659945
6140
C02057
-
-
PHENYLALANINE
Phenylalanine
ME659869
6140
C02057
-
-
CORTICOSTERONE
Corticosterone
ME659707
5753
C02140
-
-
PHOSPHOCREATINE
Phosphocreatine
ME659873
587
C02305
-
-
CYTIDINE 2`,3`-CYCLIC MONOPHOSPHATE
2',3' cyclic CMP
ME659715
68934
C02354
-
-
ARGININE
Arginine
ME659671
6322
C02385
-
-
XANTHURENIC ACID
Xanthurenic acid
ME659942
5699
C02470
-
-
ALPHA-TOCOPHEROL (*)
alpha-Tocopherol
ME659659
14985
C02477
-
-
3-NITROPROPANOATE
Bovinocidin
ME659952
1678
C02516
-
-
CHENODEOXYCHOLATE
Chenodeoxycholic acid
ME659696
10133
C02528
-
-
O-ACETYL-L-CARNITINE
CAR 2:0
ME659846
1
C02571
-
-
TAUROLITHOCHOLATE
Taurolithocholic acid
ME659915
439763
C02592
-
-
3-DEHYDROSHIKIMATE
3-Dehydroshikimate
ME659607
439774
C02637
-
-
6-CARBOXYHEXANOATE
Pimelic acid
ME659645
385
C02656
-
-
GLUCURONOLACTONE
Glucuronolactone
ME659754
439782
C02670
-
-
DODECANEDIOATE (*)
Dodecanedioic acid
ME659738
12736
C02678
-
-
LAURIC ACID
Lauric acid
ME659797
3893
C02679
-
-
INDOLE-3-ACETAMIDE
1H-Indole-3-acetamide
ME659967
397
C02693
-
-
N-ACETYL-L-LEUCINE
N-Acetylleucine
ME659825
75619
C02710
-
-
PHENYLETHANOLAMINE
2-Hydroxyphenethylamine
ME659971
1000
C02735
-
-
2,5-DIOXOPIPERAZINE
Cyclo(Gly-Gly)
ME659586
7817
C02777
-
-
3-HYDROXY-DL-KYNURENINE
Hydroxykynurenine
ME659609
89
C02794
-
-
CORTISOL 21-ACETATE
Cortisol 21-acetate
ME659708
5744
C02821
-
-
4-IMIDAZOLEACETIC ACID
Imidazoleacetic acid
ME659953
96215
C02835
-
-
S-HEXYL-GLUTATHIONE
S-Hexyl-glutathione
ME659898
97536
C02886
-
-
4-ACETAMIDOBUTANOATE
4-Acetamidobutanoic acid
ME659621
18189
C02946
-
-
2-HYDROXYSTEARATE (*)
2-Hydroxystearic acid
ME659591
439887
C03045
-
-
3-HYDROXYBENZALDEHYDE
3-Hydroxybenzaldehyde
ME659611
101
C03067
-
-
5-HYDROXYMETHYLURACIL
5-Hydroxymethyluracil
ME659641
78168
C03088
-
-
DIMETHYLBENZIMIDAZOLE
Dimethylbenzimidazole
ME659731
675
C03114
-
-
N-ACETYL-D-TRYPTOPHAN
N-Acetyl-D-tryptophan
ME659820
439917
C03137
-
-
FORMYL-L-METHIONINE
N-Formylmethionine
ME659748
6995182
C03145
-
-
DIHOMO-LINOLENATE (*)
-
ME659729
6439848
C03242
-
-
ACETYLENEDICARBOXYLATE
Acetylenedicarboxylate
ME659649
371
C03248
-
-
3-HYDROXYBENZYL ALCOHOL
3-Hydroxybenzyl alcohol
ME659612
102
C03351
-
-
4-NITROPHENYL PHOSPHATE
4-Nitrophenyl phosphate
ME659954
378
C03360
-
-
3-METHYL-2-OXOVALERIC ACID
3-Methyl-2-oxovaleric acid
ME659616
47
C03465
-
-
N-ACETYL-L-PHENYLALANINE
N-Acetylphenylalanine
ME659826
74839
C03519
-
-
THIOPURINE S-METHYLETHER
6-Methylthiopurine
ME659919
5778
C03542
-
-
(2-AMINOETHYL)PHOSPHONATE
Ciliatine
ME659948
339
C03557
-
-
METHYL BETA-D-GALACTOSIDE
Methyl beta-D-galactoside
ME659811
94214
C03619
-
-
2`,4`-DIHYDROXYACETOPHENONE
2',4'-Dihydroxyacetophenone
ME659594
6990
C03663
-
-
3-(4-HYDROXYPHENYL)LACTATE
Hydroxyphenyllactic acid
ME659605
9378
C03672
-
-
N-BENZYLOXYCARBONYLGLYCINE
N-Benzyloxycarbonylglycine
ME659832
14349
C03710
-
-
PYRIDINE-2,3-DICARBOXYLATE
Quinolinic acid
ME659886
1066
C03722
-
-
S-CARBOXYMETHYL-L-CYSTEINE
S-Carboxymethyl-cysteine
ME659897
193653
C03727
-
-
GLUCOSAMINATE
Glucosaminic acid
ME659752
73563
C03752
-
-
3-HYDROXY-3-METHYLGLUTARATE
3-Hydroxymethylglutaric acid
ME659608
1662
C03761
-
-
17BETA-HYDROXYANDROSTAN-3-ONE
5alpha-Dihydrotesosterone
ME659583
10635
C03917
-
-
THYROTROPIN RELEASING HORMONE
Thyrotropin releasing hormone
ME659923
638678
C03958
-
-
3ALPHA-HYDROXY-5BETA-CHOLANATE
Lithocholic acid
ME659619
9903
C03990
-
-
DIETHYL 2-METHYL-3-OXOSUCCINATE
4-Heptenal diethyl acetal
ME659726
97750
C04067
-
-
N6-(DELTA2-ISOPENTENYL)-ADENINE
N6-Isopentenyladenine
ME659837
92180
C04083
-
-
3,5-DIBROMO-4-HYDROXYBENZONITRILE
3,5-Dibromo-4-hydroxybenzonitrile
ME659603
15531
C04178
-
-
OCTOPAMINE
Octopamine
ME659850
440266
C04227
-
-
4-ANDROSTEN-3BETA,17BETA-DIOL DISULFATE (*)
4-Androsten-3beta,17beta-diol disulfate
ME659623
10634
C04295
-
-
ANDROSTERONE SULFATE (*)
5alpha-Androstane-3alpha-ol-17-one sulfate
ME659664
10634
C04295
-
-
NICOTINAMIDE HYPOXANTHINE DINUCLEOTIDE
Nicotinamide purin-6-ol-dinucleotide
ME659970
440334
C04423
-
-
3BETA-HYDROXYANDROST-5-EN-17-ONE 3-SULFATE
Dehydroepiandrosterone sulfate
ME659620
12594
C04555
-
-
LEUCENOL
Mimosine
ME659799
440473
C04771
-
-
TAUROCHOLATE (*)
Taurocholic acid
ME659914
6675
C05122
-
-
11-BETA-HYDROXYANDROST-4-ENE-3,17-DIONE
11beta-Hydroxyandrost-4-ene-3,17-dione
ME659581
94141
C05284
-
-
GULONO-1,4-LACTONE
D-Gulonolactone
ME659770
165105
C05410
-
-
GLYCOCHENODEOXYCHOLATE / GLYCODEOXYCHOLATE (*)
Glycodeoxycholic acid
ME659760
22833539
C05464
-
-
GLYCODEOXYCHOLATE / GLYCOCHENODEOXYCHOLATE (*)
Glycodeoxycholic acid
ME659762
22833539
C05464
-
-
TAUROCHENODEOXYCHOLATE (*)
Taurochenodeoxycholic acid
ME659913
387316
C05465
-
-
HOMOVANILLATE
Homovanillic acid
ME659780
1738
C05582
-
-
4-HYDROXY-3-METHOXYMANDELIC ACID
-
ME659628
736172
C05584
-
-
4-VINYLPHENOL SULFATE (*)
4-Hydroxystyrene
ME659635
62453
C05627
-
-
5-HYDROXYINDOLE-3-ACETIC ACID
5-Hydroxyindoleacetic acid
ME659640
1826
C05635
-
-
PHOSPHONOACETATE
Phosphonoacetate
ME659876
546
C05682
-
-
VITAMIN B12
Vitamin B12
ME659938
16212801
C05776
-
-
2-HYDROXYBUTYRIC ACID
2-Hydroxybutyric acid
ME659588
11266
C05984
-
-
N-METHYLTRYPTAMINE
N-Methyltryptamine
ME659835
6088
C06213
-
-
4-HYDROXY-3-METHOXY-BENZENEMETHANOL
4-Hydroxy-3-methoxybenzenemethanol
ME659627
62348
C06317
-
-
2-QUINOLINECARBOXYLIC ACID
Quinaldic acid
ME659593
7124
C06325
-
-
2-HYDROXYQUINOLINE
2-Hydroxyquinoline
ME659590
6038
C06338
-
-
4-QUINOLINECARBOXYLIC ACID
4-Quinolinecarboxylic acid
ME659955
10243
C06414
-
-
CAPRYLIC ACID
Caprylic acid
ME659693
379
C06423
-
-
MYRISTIC ACID
Myristic acid
ME659815
11005
C06424
-
-
ARACHIDIC ACID
Arachidic acid
ME659667
10467
C06425
-
-
GAMMA-LINOLENIC ACID
gamma-Linolenic acid
ME659750
5280933
C06426
-
-
DOCOSAHEXAENOIC ACID
Docosahexaenoic acid
ME659736
445580
C06429
-
-
PHENYLACETATE (*)
Phenyl acetate
ME659868
999
C07086
-
-
URSODIOL
Ursodeoxycholic acid
ME659937
31401
C07880
-
-
AZELAIC ACID
Azelaic acid
ME659674
2266
C08261
-
-
SUBERIC ACID
Suberic acid
ME659973
10457
C08278
-
-
BEHENIC ACID
Behenic acid
ME659676
8215
C08281
-
-
ERUCIC ACID
cis-Erucic acid
ME659741
5281116
C08316
-
-
LIGNOCERIC ACID
Lignoceric acid
ME659800
11197
C08320
-
-
MYRISTOLEIC ACID
Myristoleic acid
ME659816
5281119
C08322
-
-
NERVONIC ACID
Nervonic acid
ME659839
5281120
C08323
-
-
PALMITOLEIC ACID
Palmitoleic acid
ME659861
445638
C08362
-
-
INDICAN
Indican
ME659787
92769
C08481
-
-
CINNAMIC ACID
trans-Cinnamic acid
ME659701
5372954
C10438
-
-
ROSMARINIC ACID
Rosmarinic acid
ME659895
5281792
C10489
-
-
CYCLOHEPTANECARBOXYLIC ACID
Cycloheptanecarboxylic acid
ME659710
15091
C12104
-
-
CAPECITABINE
Capecitabine
ME659692
60953
C12650
-
-
NICOTINIC ACID ADENINE DINUCLEOTIDE PHOSPHATE
NAADP
ME659841
123953
C13051
-
-
GLYOXAL
Glyoxal
ME659964
7860
C14448
-
-
DEOXYCORTICOSTERONE ACETATE
Deoxycorticosterone acetate
ME659721
5952
C14554
-
-
2,3,5,6-TETRACHLOROPHENOL
2,3,5,6-Tetrachlorophenol
ME659584
13636
C15505
-
-
STEARIDONATE (*)
Stearidonic acid
ME659908
5282837
C16300
-
-
DIMETHYLURATE (*)
1,7-Dimethyluric acid
ME659732
91611
C16356
-
-
ASPARTATE
Aspartic acid
ME659673
5960
C16433
-
-
PROLINE
Proline
ME659882
145742
C16435
-
-
ASPARAGINE
Asparagine
ME659672
6267
C16438
-
-
LYSINE
Lysine
ME659968
5962
C16440
-
-
DOCOSAPENTAENOATE (*)
Docosapentaenoic acid
ME659737
5497182
C16513
-
-
DIHOMO-LINOLEATE (*)
11Z,14Z-Eicosadienoic acid
ME659728
6439848
C16525
-
-
DOCOSADIENOATE (*)
Docosadienoic acid
ME659735
5312554
C16533
-
-
NONADECANOATE / METHYLSTEARATE (*)
Nonadecylic acid
ME659842
12591
C16535
-
-
7-ALPHA-HYDROXY-3-OXO-4-CHOLESTENOATE (*)
7alpha-Hydroxy-3-oxo-4-cholestenoic acid
ME659648
53481411
C17337
-
-
PREGN STEROID MONOSULFATE (*)
Pregnenolone sulfate
ME659879
105074
C18044
-
-
HEXADECANEDIOATE (*)
Hexadecanedioic acid
ME659775
10459
C19615
-
-
MONO-METHYL GLUTARATE
Monomethyl glutaric acid
ME659813
73917
CA1015
-
-
ADIPIC ACID
Adipic acid
ME659656
196
CA1042
-
-
SALICYLIC ACID
Salicylic acid
ME659901
338
CA1067
-
-
5-AMINOIMIDAZOLE-4-CARBOXAMIDE-1-BETA-D-RIBOFURANO...
AICAR
ME659637
-
CA1116
-
-
CIS-11-EICOSENOIC ACID
cis-Gondoic acid
ME659703
5282768
CA1166
-
-
SALICYLAMIDE
Salicylamide
ME659899
5147
CA1193
-
-
3-NITRO-L-TYROSINE
Nitrotyrosine
ME659617
235719
CA1195
-
-
N-ACETYL-L-ASPARTIC ACID
N-Acetylaspartic acid
ME659823
65065
CA1200
-
-
O-PHOSPHO-DL-SERINE
DL-O-Phosphoserine
ME659847
106
CA1209
-
-
N-ACETYL-DL-METHIONINE
N-Acetylmethionine
ME659822
448580
CA1210
-
-
N-ACETYLGLYCINE
N-Acetylglycine
ME659827
10972
CA1212
-
-
N-ALPHA-ACETYL-L-ASPARAGINE
N-Acetylasparagine
ME659830
-
CA1214
-
-
N-ALPHA-ACETYL-L-LYSINE
N(2)-Acetyllysine
ME659831
92907
CA1219
-
-
3,4-DIHYDROXYPHENYL GLYCOL
3,4-Dihydroxyphenylglycol
ME659602
91528
CA1222
-
-
METHYL INDOLE-3-ACETATE
Indole-3-methyl acetate
ME659812
74706
CA1231
-
-
N-OLEOYLGLYCINE
N-Oleoyl glycine
ME659836
6436908
CA1254
-
-
CIS-7,10,13,16-DOCOSATETRAENOIC ACID
Adrenic acid
ME659704
5497181
CA1260
-
-
N-FORMYLGLYCINE
N-Formylglycine
ME659834
75606
CA1268
-
-
TRICOSANOIC ACID
Tricosylic acid
ME659925
17085
CA1269
-
-
PTERIN
Pterin
ME659883
73000
CA1303
-
-
3-METHYL-2-OXINDOLE
3-Methyloxindole
ME659615
150923
CA1325
-
-
N-CYCLOHEXYLSULFAMIC ACID
Cyclamic acid
ME659833
7533
CA1328
-
-
BOC-MET-OH
-
ME659688
-
CA1332
-
-
BOC-ALA-OH
-
ME659683
-
CA1333
-
-
BOC-PHE-OH
-
ME659689
-
CA1334
-
-
BOC-PRO-OH
-
ME659690
-
CA1335
-
-
BOC-HIS-OH
-
ME659687
-
CA1336
-
-
ANILINE-2-SULFONIC ACID
2-Aminobenzenesulfonic acid
ME659665
6926
CA1341
-
-
GLYCOLITHOCHOLIC ACID ETHYL ESTER
-
ME659763
-
CA1349
-
-
BOC-ASP-OH
-
ME659686
-
CA1350
-
-
HEXACOSANOIC ACID
Cerotic acid
ME659774
10469
CA1352
-
-
3-METHOXY-L-TYROSINE
3-Methoxytyrosine
ME659614
9307
CA1364
-
-
HEPTADECANOATE
Margaric acid
ME659771
10465
CA1365
-
-
TRIDECANOIC ACID
Tridecylic acid
ME659926
12530
CA1367
-
-
1,2-DIDECANOYL-SN-GLYCERO-3-PHOSPHOCHOLINE
PC 10:0/10:0
ME659579
-
CA1375
-
-
NORMETANEPHRINE
Normetanephrine
ME659845
1237
CA1379
-
-
HEPTANOIC ACID
Heptylic acid
ME659773
8094
CA1393
-
-
LAUROYLCARNITINE
CAR 12:0
ME659798
10427569
CA1406
-
-
DEHYDROISOANDROSTERONE 3-SULFATE
Dehydroepiandrosterone sulfate
ME659720
12594
CA1407
-
-
4-HYDROXY-3-METHOXYPHENYLGLYCOL
Vanylglycol
ME659629
10805
CA1410
-
-
BOC-A-(1-NAPHTHYLMETHYL)-DL-PRO-OH
-
ME659681
-
CA1419
-
-
GLUCOSAMINE 6-SULFATE
Glucosamine 6-sulfate
ME659962
72361
CA1422
-
-
BOC-THR-OH
-
ME659691
-
CA1425
-
-
4-HYDROXY-L-PHENYLGLYCINE
4-Hydroxyphenylglycine
ME659630
36143
CA1445
-
-
N-ACETYL-DL-GLUTAMIC ACID
N-Acetylglutamic acid
ME659821
70914
CA1454
-
-
P-BROMO-DL-PHENYLALANINE
P-Bromo-DL-phenylalanine
ME659859
85681
CA1463
-
-
OPHTHALMIC ACID
Ophthalmic acid
ME659853
7018721
CA1475
-
-
DIHEXOSE
-
ME659727
-
CA1495
-
-
PHOSPHOGLYCERIC ACID
Phosphoglyceric acid
ME659875
724
CA1497
-
-
AMINOBUTANOIC ACID
Aminobutyric acid
ME659660
119
CA1498
-
-
AMINOPENTANOIC ACID
Aminopentanoic acid
ME659663
-
CA1501
-
-
AMINOHEXANOIC ACID
Aminocaproic acid
ME659661
564
CA1502
-
-
HEXURONIC ACID
Hexuronic acid
ME659778
152867
CA1503
-
-
DIMETHYLXANTHINE
-
ME659733
-
CA1507
-
-
DIMETHYLXANTHINE (*)
-
ME659734
-
CA1507
-
-
AMINOHYDROXYBUTANOIC ACID
-
ME659662
-
CA1508
-
-
PYRIDINE CARBOXYLIC ACID
-
ME659885
-
CA1509
-
-
HEXITOL
Sorbitol
ME659777
453
CA1510
-
-
PENTITOL
Arabitol
ME659866
827
CA1511
-
-
GLYCEROL PHOSPHATE
sn-Glycero-3-phosphate
ME659759
439162
CA1512
-
-
HYDROXYBENZOIC ACID
Hydroxybenzoic acid
ME659782
135
CA1517
-
-
CHOLESTEROL SULFATE
Cholesterol sulfate
ME659699
65076
CA1523
-
-
N-ACETYL-L-CYSTEINE
N-Acetylcysteine
ME659824
12035
CE1310
-
-
OLEOYLGLYCEROPHOSPHOETHANOLAMINE (*)
LPE 18:1
ME659852
-
K21510
-
-
HYDROXYDECANOATE (*)
Hydroxydecanoic acid
ME659783
-
K21895
-
-
ARACHIDONOYLGLYCEROPHOSPHOETHANOLAMINE (*)
-
ME659669
-
K22267
-
-
PALMITOYLGLYCEROPHOSPHOETHANOLAMINE / PALMITOYLPLA...
-
ME659862
-
K22338
-
-
HEPTADECENOATE (*)
Heptadecenoic acid
ME659772
-
K22942
-
-
DODECENOATE (*)
Dodecenoic acid
ME659739
-
K23296
-
-
HYDROXYISOVALERATE (*)
-
ME659784
-
K23382
-
-
P-ACETAMIDOPHENYLGLUCURONIDE (*)
p-Acetamidophenylglucuronide
ME659858
4022661
K23498
-
-
ARACHIDONOYLGLYCEROPHOSPHOINOSITOL (*)
-
ME659670
-
K24042
-
-
STEAROYLGLYCEROPHOSPHOETHANOLAMINE (*)
LPE 18:0
ME659909
-
K24332
-
-
SALICYLURIC GLUCURONIDE (*)
Salicyluric glucuronide
ME659902
-
K24500
-
-
HYDROXYACETAMINOPHEN SULFATE (*)
Hydroxyacetaminophen sulfate
ME659781
-
K24525
-
-
CINNAMOYLGLYCINE (*)
Cinnamoylglycine
ME659702
709625
K24551
-
-
LINOLEOYLGLYCEROPHOSPHOETHANOLAMINE (*)
LPE 18:2
ME659802
-
K24671
-
-
PALMITOYLGLYCEROPHOSPHOINOSITOL (*)
LPI 16:0
ME659863
-
K25208
-
-
DESMETHYLNAPROXEN SULFATE (*)
-
ME659724
-
K25428
-
-
3-CARBOXY-4-METHYL-5-PROPYL-2-FURANPROPANOATE
3-Carboxy-4-methyl-5-propyl-2-furanpropanoic acid
ME659606
123979
K25632
-
-
INDOLEPROPIONATE (*)
3-Indolepropionic acid
ME659790
3744
K25954
-
-
OCTADECANEDIOATE (*)
Octadecanedioic acid
ME659849
70095
K26463
-
-
BOC-ALA
-
ME659682
-
-
-
-
BOC-ASN
-
ME659684
-
-
-
-
UCSD Metabolomics Workbench, a resource sponsored by the Common Fund of the National Institutes of Health
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