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Analysis: MS Q-TOF 6530 positive ion mode
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
PHOSPHATE
Phosphoric acid
ME658655
1004
C00009
-
-
FLAVIN ADENINE DINUCLEOTIDE
FAD
ME658517
643975
C00016
-
-
S-ADENOSYL METHIONINE
S-Adenosylmethionine
ME658687
34755
C00019
-
-
ADENOSINE 5`-MONOPHOSPHATE
AMP
ME658398
6083
C00020
-
-
ADENOSINE 5`-MONOPHOSPHATE (*)
AMP
ME658399
6083
C00020
-
-
S-ADENOSYL-L-HOMOCYSTEINE
S-Adenosylhomocysteine
ME658688
439155
C00021
-
-
ALPHA-KETO-GLUTARATE
2-Oxoglutaric acid
ME658403
51
C00026
-
-
GUANOSINE 5`-DIPHOSPHATE
GDP
ME658539
8977
C00035
-
-
GLYCINE
Glycine
ME658534
750
C00037
-
-
SUCCINATE (*)
Succinic acid
ME658709
1110
C00042
-
-
GLUTATHIONE
Glutathione
ME658530
124886
C00051
-
-
ASCORBATE
Vitamin C
ME658413
54670067
C00072
-
-
TYROSINE (*)
Tyrosine
ME658726
6057
C00082
-
-
UREA
Urea
ME658730
1176
C00086
-
-
INOSINE 5`-DIPHOSPHATE
IDP
ME658563
6831
C00104
-
-
URIDINE-5-MONOPHOSPHATE
UMP
ME658732
6030
C00105
-
-
ANTHRANILATE
2-Aminobenzoic acid
ME658410
227
C00108
-
-
RIBOSE 5-PHOSPHATE
Ribose 5-phosphate
ME658685
439167
C00117
-
-
BIOTIN
Biotin
ME658422
171548
C00120
-
-
INOSINE 5`-MONOPHOSPHATE
IMP
ME658564
8582
C00130
-
-
HISTIDINE (*)
Histidine
ME658547
6274
C00135
-
-
NICOTINAMIDE
Niacinamide
ME658623
936
C00153
-
-
CITRATE
Citric acid
ME658453
311
C00158
-
-
HEXOSE (*)
Hexose
ME658544
206
C00159
-
-
DIPALMITOYLGLYCEROL (*)
DG 16:0_16:0
ME658498
644078
C00165
-
-
5`-METHYLTHIOADENOSINE
5'-Methylthioadenosine
ME658391
439176
C00170
-
-
VALINE (*)
Valine
ME658736
6287
C00183
-
-
ETHANOLAMINE
Ethanolamine
ME658512
700
C00189
-
-
D-GLUCONO-1,5-LACTONE
Gluconolactone
ME658472
7027
C00198
-
-
2`-DEOXYADENOSINE 5`-DIPHOSPHATE
dADP
ME658341
188966
C00206
-
-
ADENOSINE
Adenosine
ME658396
60961
C00212
-
-
THYMIDINE
Thymidine
ME658715
5789
C00214
-
-
3,4-DIHYDROXYBENZOATE
Protocatechuic acid
ME658347
72
C00230
-
-
4-METHYL-2-OXOPENTANOATE
Ketoleucine
ME658377
70
C00233
-
-
GUANINE
Guanine
ME658537
764
C00242
-
-
TAURINE
Taurine
ME658710
1123
C00245
-
-
ALPHA-LIPOAMIDE
Lipoamide
ME658404
863
C00248
-
-
PYRIDOXAL
Pyridoxal
ME658674
1050
C00250
-
-
RIBOFLAVIN
Riboflavin
ME658684
493570
C00255
-
-
GLYCERIC ACID
Glyceric acid
ME658532
439194
C00258
-
-
HYPOXANTHINE
Hypoxanthine
ME658556
790
C00262
-
-
HOMOSERINE
Homoserine
ME658550
12647
C00263
-
-
6,7-DIHYDROBIOPTERIN
4a-Carbinolamine tetrahydrobiopterin
ME658392
133246
C00268
-
-
N-ACETYLNEURAMINATE
N-Acetylneuraminic acid
ME658609
439197
C00270
-
-
EDTA
Edetic acid
ME658504
6049
C00284
-
-
EDTA (*)
Edetic acid
ME658505
6049
C00284
-
-
ANILINE
Aniline
ME658409
6115
C00292
-
-
INOSINE
Inosine
ME658562
6021
C00294
-
-
QUINATE
Quinic acid
ME658678
6508
C00296
-
-
URIDINE
Uridine
ME658731
6029
C00299
-
-
CREATINE
Creatine
ME658460
586
C00300
-
-
GLUTAMIC ACID
Glutamic acid
ME658526
33032
C00302
-
-
GLUTAMINE
Glutamine
ME658527
5961
C00303
-
-
BRADYKININ (*)
Bradykinin
ME658436
439201
C00306
-
-
BRADYKININ DES-ARG(9) (*)
Bradykinin
ME658437
439201
C00306
-
-
BRADYKININ HYDROXY-PRO(3) (*)
Bradykinin
ME658438
439201
C00306
-
-
CYTIDINE 5`-DIPHOSPHOCHOLINE
CDP-choline
ME658469
13804
C00307
-
-
ISOCITRIC ACID
Isocitric acid
ME658565
1198
C00311
-
-
PYRIDOXINE
Pyridoxine
ME658676
1054
C00314
-
-
SPERMIDINE
Spermidine
ME658697
1102
C00315
-
-
CITRULLINE
Citrulline
ME658454
9750
C00327
-
-
2`-DEOXYGUANOSINE
Deoxyguanosine
ME658344
187790
C00330
-
-
DIHYDROOROTATE
4,5-Dihydroorotic acid
ME658489
648
C00337
-
-
6-PHOSPHOGLUCONIC ACID
6-Phosphogluconic acid
ME658394
91493
C00345
-
-
GLUCOSAMINE 6-PHOSPHATE
Glucosamine 6-phosphate
ME658525
439217
C00352
-
-
3,4-DIHYDROXY-L-PHENYLALANINE
DOPA
ME658346
6047
C00355
-
-
2`-DEOXYADENOSINE 5`-MONOPHOSPHATE
dUMP
ME658342
12599
C00360
-
-
2`-DEOXYGUANOSINE 5`-MONOPHOSPHATE
dGMP
ME658345
65059
C00362
-
-
URATE
Uric acid
ME658727
1175
C00366
-
-
URATE (*)
Uric acid
ME658728
1175
C00366
-
-
RETINAL
Retinal
ME658681
638015
C00376
-
-
CYTOSINE
Cytosine
ME658470
597
C00380
-
-
XANTHINE
Xanthine
ME658739
1188
C00385
-
-
CARNOSINE
Carnosine
ME658445
439224
C00386
-
-
GUANOSINE
Guanosine
ME658538
6802
C00387
-
-
TRYPTAMINE
Tryptamine
ME658721
1150
C00398
-
-
PIPECOLIC ACID
Pipecolic acid
ME658660
849
C00408
-
-
PROGESTERONE
Progesterone
ME658666
5994
C00410
-
-
DIHYDROFOLATE
Dihydrofolic acid
ME658488
98792
C00415
-
-
CIS-ACONITATE
cis-Aconitic acid
ME658451
643757
C00417
-
-
5-AMINOLEVULINIC ACID
5-Amino-levulinic acid
ME658381
137
C00430
-
-
ESTRONE
Estrone
ME658511
5870
C00468
-
-
RETINOL
Retinol
ME658683
445354
C00473
-
-
CYTIDINE
Cytidine
ME658468
6175
C00475
-
-
GLUTARATE
Glutaric acid
ME658528
743
C00489
-
-
RAFFINOSE
Raffinose
ME658680
439242
C00492
-
-
SHIKIMATE
Shikimic acid
ME658694
8742
C00493
-
-
BILIVERDIN
Biliverdin
ME658420
5280353
C00500
-
-
ERYTHRITOL
Erythritol
ME658509
222285
C00503
-
-
FOLIC ACID
Folic acid
ME658518
6037
C00504
-
-
ANDROSTERONE
Androsterone
ME658408
5879
C00523
-
-
DEOXYURIDINE
Deoxyuridine
ME658477
13712
C00526
-
-
HYDROQUINONE
Hydroquinone
ME658553
785
C00530
-
-
PYRIDOXAMINE
Pyridoxamine
ME658675
1052
C00534
-
-
TESTOSTERONE
Testosterone
ME658711
6013
C00535
-
-
CYSTATHIONINE
Cystathionine
ME658465
439258
C00542
-
-
HOMOGENTISATE
Homogentisic acid
ME658549
780
C00544
-
-
SPHINGOMYELIN
SM 18:1;O2/18:0
ME658700
53481362
C00550
-
-
SPHINGOMYELIN (CATION)
SM 18:0;O2/22:1
ME658701
53481362
C00550
-
-
STEAROYL SPHINGOMYELIN (*)
SM 18:1;O2/18:0
ME658705
6453725
C00550
-
-
2`-DEOXYADENOSINE
Deoxyadenosine
ME658340
13730
C00559
-
-
TRIMETHYLAMINE
Trimethylamine
ME658720
1146
C00565
-
-
4-AMINOBENZOATE
p-Aminobenzoic acid
ME658369
978
C00568
-
-
ADENOSINE 3`,5`-CYCLIC MONOPHOSPHATE
3',5' cyclic AMP
ME658397
6076
C00575
-
-
2-DEOXY-D-GLUCOSE
2-Deoxy-glucose
ME658332
439268
C00586
-
-
PHOSPHOCHOLINE
Choline phosphate
ME658656
135437
C00588
-
-
3-HYDROXYANTHRANILATE
3-Hydroxyanthranilic acid
ME658359
86
C00632
-
-
4-HYDROXYBENZALDEHYDE
4-Hydroxybenzaldehyde
ME658376
126
C00633
-
-
INDOLE-3-ACETALDEHYDE
Indoleacetaldehyde
ME658557
800
C00637
-
-
LL-2,6-DIAMINOHEPTANEDIOATE
2,6-Diaminopimelic acid
ME658574
1549100
C00666
-
-
GLYCEROPHOSPHORYLCHOLINE (*)
sn-Glycero-3-phosphocholine
ME658533
657272
C00670
-
-
SN-GLYCERO-3-PHOSPHOCHOLINE
sn-Glycero-3-phosphocholine
ME658695
657272
C00670
-
-
CHOLIC ACID
Cholic acid
ME658446
221493
C00695
-
-
MALATE
Malic acid
ME658577
222656
C00711
-
-
PTERIN
Pterin
ME658671
73000
C00715
-
-
BETAINE
Betaine
ME658419
247
C00719
-
-
CORTISOL
Cortisol
ME658456
5754
C00735
-
-
CYSTEINE
Cysteine
ME658466
594
C00736
-
-
SPERMINE
Spermine
ME658698
1103
C00750
-
-
SQUALENE
Squalene
ME658702
5280370
C00751
-
-
CORTISONE
Cortisone
ME658458
222786
C00762
-
-
HISTIDINE
Histidine
ME658546
6274
C00768
-
-
RETINOATE
Retinoic acid
ME658682
444795
C00777
-
-
SEROTONIN
Serotonin
ME658693
5202
C00780
-
-
UROCANATE
Urocanic acid
ME658733
1549103
C00785
-
-
EPINEPHRINE
Epinephrine
ME658508
5816
C00788
-
-
CREATININE
Creatinine
ME658461
588
C00791
-
-
CREATININE FROM COMPLEX
Creatinine
ME658462
588
C00791
-
-
SALICYLIC ACID
Salicylic acid
ME658690
338
C00805
-
-
TRYPTOPHAN
Tryptophan
ME658722
6305
C00806
-
-
4-COUMARATE
cis-p-Coumaric acid
ME658371
637542
C00811
-
-
CITRAMALATE
Citramalic acid
ME658452
1081
C00815
-
-
MENAQUINONE
Menaquinone
ME658579
5280374
C00828
-
-
OXOMALONATE
Mesoxalic acid
ME658636
10132
C00830
-
-
SPHINGANINE
Sphinganine
ME658699
91486
C00836
-
-
4-PYRIDOXATE
4-Pyridoxic acid
ME658380
6723
C00847
-
-
HISTIDINOL
L-Histidinol
ME658548
165271
C00860
-
-
PANTOTHENIC ACID
Pantothenic acid
ME658644
988
C00864
-
-
2`-DEOXYCYTIDINE
Deoxycytidine
ME658343
13711
C00881
-
-
3`-DEPHOSPHO COA
3'-Dephospho-CoA
ME658367
444485
C00882
-
-
INDOLE-3-ACETIC ACID
Indoleacetic acid
ME658559
802
C00954
-
-
INDOLE-3-ETHANOL
Tryptophanol
ME658560
10685
C00955
-
-
TRYPTOPHANAMIDE
Tryptophanamide
ME658724
439356
C00977
-
-
N-ACETYLSEROTONIN
N-Acetylserotonin
ME658611
903
C00978
-
-
TRIGONELLINE
Trigonelline
ME658719
5570
C01004
-
-
PANTOLACTONE
Pantolactone
ME658643
439368
C01012
-
-
5-HYDROXY-L-TRYPTOPHAN
5-Hydroxy-tryptophan
ME658383
439280
C01017
-
-
4-GUANIDINOBUTANOIC ACID
4-Guanidinobutanoic acid
ME658372
500
C01035
-
-
CYCLOHEXANE-1,3-DIONE
Cyclohexane-1,3-dione
ME658464
10434
C01066
-
-
OROTIDINE 5`-MONOPHOSPHATE
Orotidylic acid
ME658635
160617
C01103
-
-
O-SUCCINYL-L-HOMOSERINE
o-Succinylhomoserine
ME658628
439406
C01118
-
-
N-ACETYL-D-GALACTOSAMINE
N-Acetyl-D-galactosamine
ME658598
35717
C01132
-
-
N(PAI)-METHYL-L-HISTIDINE
3-Methylhistidine
ME658596
64969
C01152
-
-
BISPHOSPHOGLYCERATE
2,3-Diphosphoglyceric acid
ME658424
186004
C01159
-
-
3,4-DIHYDROXYPHENYLACETATE
3,4-Dihydroxybenzeneacetic acid
ME658349
547
C01161
-
-
17ALPHA-HYDROXYPROGESTERONE
17alpha-Hydroxyprogesterone
ME658328
6238
C01176
-
-
3-(4-HYDROXYPHENYL)PYRUVATE
4-Hydroxyphenylpyruvic acid
ME658352
979
C01179
-
-
3-(2-HYDROXYPHENYL)PROPANOATE
3-(2-Hydroxyphenyl)propanoic acid
ME658350
873
C01198
-
-
HEXOSE
Hexose
ME658543
206
C01381
-
-
PRENOL
3-Methyl-2-buten-1-ol
ME658664
11173
C01390
-
-
ALANINE
Alanine
ME658401
5950
C01401
-
-
BENZOIN
Benzoin
ME658418
8400
C01408
-
-
BOC-ASN
-
ME658427
82035
C01410
-
-
CYSTINE
Cystine
ME658467
595
C01420
-
-
CAFFEIC ACID
Caffeic acid
ME658442
1549111
C01481
-
-
FERULATE
trans-Ferulic acid
ME658516
445858
C01494
-
-
TYROSINE
Tyrosine
ME658725
6057
C01536
-
-
ALLANTOIN
Allantoin
ME658402
204
C01551
-
-
HIPPURATE
Hippuric acid
ME658545
464
C01586
-
-
MELATONIN
Melatonin
ME658578
896
C01598
-
-
ORNITHINE
Ornithine
ME658634
6262
C01602
-
-
PHTHALATE
Phthalic acid
ME658658
1017
C01606
-
-
STACHYOSE
Stachyose
ME658703
439531
C01613
-
-
CADAVERINE
Cadaverine
ME658441
273
C01672
-
-
KYNURENIC ACID
Kynurenic acid
ME658567
3845
C01717
-
-
KYNURENINE
Kynurenine
ME658568
161166
C01718
-
-
LUMICHROME
Lumichrome
ME658575
5326566
C01727
-
-
METHIONINE
Methionine
ME658580
6137
C01733
-
-
XANTHOSINE
Xanthosine
ME658740
64959
C01762
-
-
DEOXYRIBOSE
Deoxyribose
ME658476
9828112
C01801
-
-
THYROXINE
Thyroxine
ME658716
5819
C01829
-
-
5-OXO-PROLINE
Pyroglutamic acid
ME658388
499
C01879
-
-
DETHIOBIOTIN
Dethiobiotin
ME658478
445027
C01909
-
-
GLYCOCHOLATE
Glycocholic acid
ME658535
10140
C01921
-
-
PREGNENOLONE
Pregnenolone
ME658663
8955
C01953
-
-
2-HYDROXYPHENYLACETIC ACID
2-Hydroxyphenylacetic acid
ME658335
11914
C01983
-
-
2-AMINOPHENOL
2-Aminophenol
ME658331
5801
C01987
-
-
PHENYLALANINE
Phenylalanine
ME658653
6140
C02057
-
-
CORTICOSTERONE
Corticosterone
ME658455
5753
C02140
-
-
METHYLMALONATE
Methylmalonic acid
ME658590
487
C02170
-
-
PROTOPORPHYRIN
Protoporphyrin
ME658670
4971
C02191
-
-
2-METHYLMALEATE
Citraconic acid
ME658337
643798
C02226
-
-
5-VALEROLACTONE
5-Valerolactone
ME658389
10953
C02240
-
-
METHYLGUANIDINE
Methylguanidine
ME658589
10111
C02294
-
-
5-METHYLCYTOSINE
5-Methylcytosine
ME658387
65040
C02376
-
-
N-ETHYLMALEIMIDE
N-Ethylmaleimide
ME658618
4362
C02441
-
-
XANTHURENIC ACID
Xanthurenic acid
ME658741
5699
C02470
-
-
ALPHA-TOCOPHEROL
alpha-Tocopherol
ME658405
14985
C02477
-
-
1-METHYLADENOSINE
1-Methyladenosine
ME658322
27476
C02494
-
-
ESTRADIOL 17 ALPHA
Estradiol-17alpha
ME658510
68570
C02537
-
-
O-ACETYL-L-CARNITINE
CAR 2:0
ME658625
1
C02571
-
-
3-DEHYDROCARNITINE
3-Dehydrocarnitine
ME658355
6991982
C02636
-
-
3-DEHYDROSHIKIMATE
3-Dehydroshikimate
ME658356
439774
C02637
-
-
PIMELIC ACID
Pimelic acid
ME658659
385
C02656
-
-
INDOLE-3-ACETAMIDE
1H-Indole-3-acetamide
ME658558
397
C02693
-
-
N-ACETYL-L-LEUCINE
N-Acetylleucine
ME658606
75619
C02710
-
-
N-ACETYLPUTRESCINE
N-Acetylputrescine
ME658610
122356
C02714
-
-
PHENYLETHANOLAMINE
2-Hydroxyphenethylamine
ME658654
1000
C02735
-
-
10-HYDROXYDECANOATE
10-Hydroxydecanoic acid
ME658325
74300
C02774
-
-
3-HYDROXY-DL-KYNURENINE
Hydroxykynurenine
ME658358
89
C02794
-
-
5-HYDROXYPENTANOIC ACID
5-Hydroxyvaleric acid
ME658386
25945
C02804
-
-
CORTISOL 21-ACETATE
Cortisol 21-acetate
ME658457
5744
C02821
-
-
OCTANOYLCARNITINE (*)
CAR 8:0
ME658629
123701
C02838
-
-
S-HEXYL-GLUTATHIONE
S-Hexyl-glutathione
ME658689
97536
C02886
-
-
4-ACETAMIDOBUTANOATE
4-Acetamidobutanoic acid
ME658368
18189
C02946
-
-
PALMITOYLCARNITINE (*)
CAR 16:0
ME658641
11953816
C02990
-
-
PROPIONYLCARNITINE (*)
CAR 3:0
ME658669
188824
C03017
-
-
2,6-DIHYDROXYPYRIDINE
2,6-Dihydroxypyridine
ME658329
69371
C03056
-
-
3-HYDROXYBENZALDEHYDE
3-Hydroxybenzaldehyde
ME658360
101
C03067
-
-
5-HYDROXYMETHYLURACIL
5-Hydroxymethyluracil
ME658385
78168
C03088
-
-
DIMETHYLBENZIMIDAZOLE
Dimethylbenzimidazole
ME658493
675
C03114
-
-
N-ACETYL-D-TRYPTOPHAN
N-Acetyl-D-tryptophan
ME658600
439917
C03137
-
-
FORMYL-L-METHIONINE
N-Formylmethionine
ME658519
6995182
C03145
-
-
4-NITROPHENYL PHOSPHATE
4-Nitrophenyl phosphate
ME658379
378
C03360
-
-
5-AMINOIMIDAZOLE RIBOTIDE (*)
AIR
ME658382
161500
C03373
-
-
N-ACETYL-L-PHENYLALANINE
N-Acetylphenylalanine
ME658607
74839
C03519
-
-
THIOPURINE S-METHYLETHER
6-Methylthiopurine
ME658713
5778
C03542
-
-
METHYL BETA-D-GALACTOSIDE
Methyl beta-D-galactoside
ME658583
94214
C03619
-
-
DIMETHYLARGININE (*)
Dimethylarginine
ME658492
123831
C03626
-
-
2`,4`-DIHYDROXYACETOPHENONE
2',4'-Dihydroxyacetophenone
ME658339
6990
C03663
-
-
3-(4-HYDROXYPHENYL)LACTATE
Hydroxyphenyllactic acid
ME658351
9378
C03672
-
-
BIS(2-ETHYLHEXYL)PHTHALATE
Bis(2-ethylhexyl)phthalate
ME658423
8343
C03690
-
-
N-BENZYLOXYCARBONYLGLYCINE
N-Benzyloxycarbonylglycine
ME658614
14349
C03710
-
-
PYRIDINE-2,3-DICARBOXYLATE
Quinolinic acid
ME658673
1066
C03722
-
-
TRANS-CYCLOHEXANE-1,2-DIOL
trans-Cyclohexane-1,2-diol
ME658718
92886
C03739
-
-
DOPAMINE
Dopamine
ME658503
681
C03758
-
-
3-HYDROXY-3-METHYLGLUTARATE
3-Hydroxymethylglutaric acid
ME658357
1662
C03761
-
-
N,N,N-TRIMETHYLLYSINE
N-6-Trimethyllysine
ME658597
440120
C03793
-
-
PIPERINE (*)
Piperine
ME658661
638024
C03882
-
-
OLEOYLGLYCEROPHOSPHOCHOLINE (*)
LPC 18:1
ME658632
5280634
C03916
-
-
3ALPHA-HYDROXY-5BETA-CHOLANATE
Lithocholic acid
ME658365
9903
C03990
-
-
N6-(DELTA2-ISOPENTENYL)-ADENINE
N6-Isopentenyladenine
ME658622
92180
C04083
-
-
PALMITOYLGLYCEROPHOSPHOCHOLINE (*)
LPC 16:0
ME658642
460602
C04102
-
-
HEPTADECANOYLGLYCEROPHOSPHOCHOLINE (*)
LPC 17:0
ME658541
53480465
C04230
-
-
MYRISTOYLGLYCEROPHOSPHOCHOLINE (*)
LPC 14:0
ME658595
460604
C04230
-
-
DEOXYCHOLATE
Deoxycholic acid
ME658474
222528
C04483
-
-
LEUCENOL
Mimosine
ME658570
440473
C04771
-
-
5`-DEOXYADENOSINE
5'-Deoxyadenosine
ME658390
439182
C05198
-
-
ARACHIDONOYLGLYCEROPHOSPHOCHOLINE (*)
LPC 20:4
ME658411
-
C05208
-
-
11-BETA-HYDROXYANDROST-4-ENE-3,17-DIONE
11beta-Hydroxyandrost-4-ene-3,17-dione
ME658326
94141
C05284
-
-
PHENETHYLAMINE
Phenylethylamine
ME658650
1001
C05332
-
-
GULONO-1,4-LACTONE
D-Gulonolactone
ME658540
165105
C05410
-
-
VITAMIN D2
Vitamin D2
ME658737
5280793
C05441
-
-
VITAMIN D3
Vitamin D3
ME658738
10883523
C05443
-
-
HOMOVANILLATE
Homovanillic acid
ME658552
1738
C05582
-
-
4-HYDROXY-3-METHOXYMANDELIC
Vanillylmandelic acid
ME658373
736172
C05584
-
-
4-HYDROXY-3-METHOXYMANDELIC ACID
-
ME658374
736172
C05584
-
-
3-METHOXYTYRAMINE
3-Methoxytyramine
ME658362
1669
C05587
-
-
PHENYLACETYLGLUTAMINE (*)
alpha-N-Phenylacetylglutamine
ME658652
92258
C05597
-
-
5-HYDROXYINDOLE-3-ACETIC ACID
5-Hydroxyindoleacetic acid
ME658384
1826
C05635
-
-
INDOXYL
Indoxyl
ME658561
50591
C05658
-
-
PHOSPHONOACETATE
Phosphonoacetate
ME658657
546
C05682
-
-
N1-METHYL-2-PYRIDONE-5-CARBOXAMIDE (*)
N1-Methyl-2-pyridone-5-carboxamide
ME658620
69698
C05842
-
-
2-HYDROXYBUTYRIC ACID
2-Hydroxybutyric acid
ME658334
11266
C05984
-
-
BIOPTERIN
Biopterin
ME658421
445040
C06313
-
-
2-QUINOLINECARBOXYLIC ACID
Quinaldic acid
ME658338
7124
C06325
-
-
QUINOLIN-2-OL
2-Hydroxyquinoline
ME658679
6038
C06338
-
-
DOCOSAHEXAENOIC ACID
Docosahexaenoic acid
ME658499
445580
C06429
-
-
4-METHYLCATECHOL
4-Methylcatechol
ME658378
9958
C06730
-
-
DIETHANOLAMINE
Diethanolamine
ME658485
8113
C06772
-
-
PHENYLACETIC ACID
Phenylacetic acid
ME658651
999
C07086
-
-
THEOPHYLLINE
Theophylline
ME658712
2153
C07130
-
-
PENICILLAMINE
Penicillamine
ME658646
4727
C07418
-
-
CAFFEINE
Caffeine
ME658443
2519
C07481
-
-
7-AMINOCEPHALOSPORANIC ACID
7-Aminocephalosporanic acid
ME658395
441328
C07756
-
-
URSODIOL
Ursodeoxycholic acid
ME658734
31401
C07880
-
-
AZELAIC ACID
Azelaic acid
ME658416
2266
C08261
-
-
SUBERIC ACID
Suberic acid
ME658708
10457
C08278
-
-
HOMOSTACHYDRINE (*)
(S)-Homostachydrine
ME658551
441447
C08283
-
-
12-HYDROXY-DODECANOIC ACID
12-Hydroxy lauric acid
ME658327
79034
C08317
-
-
TRYPTOPHAN BETAINE (*)
Lenticin
ME658723
442106
C09213
-
-
SALSOLINOL
Salsolinol
ME658691
54456
C09642
-
-
ROSMARINIC ACID
Rosmarinic acid
ME658686
5281792
C10489
-
-
METHYL JASMONATE
Methyl jasmonate
ME658585
5281929
C11512
-
-
N-CYCLOHEXYLFORMAMIDE
N-Cyclohexylformamide
ME658616
13017
C11519
-
-
CYCLOHEX-1-ENECARBOXYLIC ACID
Cyclohex-1-enecarboxylic acid
ME658463
69470
C12101
-
-
CAPECITABINE
Capecitabine
ME658444
60953
C12650
-
-
STEARAMIDE (*)
Stearamide
ME658704
31292
C13846
-
-
DEOXYCORTICOSTERONE
Deoxy-corticosterone
ME658475
6166
C14554
-
-
1-NAPHTHYLAMINE
1-Naphthylamine
ME658323
8640
C14790
-
-
METHYLXANTHINE (*)
Methylxanthine
ME658591
68374
C16353
-
-
ASPARTATE
Aspartic acid
ME658415
5960
C16433
-
-
PROLINE
Proline
ME658667
145742
C16435
-
-
VALINE
Valine
ME658735
6287
C16436
-
-
ASPARAGINE
Asparagine
ME658414
6267
C16438
-
-
LEUCINE
Leucine
ME658571
6106
C16439
-
-
LYSINE
Lysine
ME658576
5962
C16440
-
-
MONO-METHYL GLUTARATE
Monomethyl glutaric acid
ME658594
73917
CA1015
-
-
ENKEPHALINE, (D-ALA)2-LEU
-
ME658507
-
CA1037
-
-
MEVALOLACTONE
Mevalolactone
ME658592
-
CA1091
-
-
2-METHYLGLUTARIC ACID
2-Methylglutaric acid
ME658336
12046
CA1107
-
-
1,2-DIPALMITOYL-SN-GLYCEROL
DG 16:0_16:0
ME658321
-
CA1156
-
-
N-ACETYL-L-ASPARTIC ACID
N-Acetylaspartic acid
ME658604
65065
CA1200
-
-
BOC-GLY-OH
-
ME658429
-
CA1201
-
-
3-UREIDOPROPIONIC ACID
Ureidopropionic acid
ME658364
111
CA1202
-
-
O-PHOSPHO-DL-SERINE
DL-O-Phosphoserine
ME658626
106
CA1209
-
-
N-ACETYL-DL-METHIONINE
N-Acetylmethionine
ME658602
448580
CA1210
-
-
N-ACETYLGLYCINE
N-Acetylglycine
ME658608
10972
CA1212
-
-
ETHYL 3-INDOLE ACETATE
Ethyl 3-indoleacetate
ME658513
-
CA1213
-
-
N-ALPHA-ACETYL-L-ASPARAGINE
N-Acetylasparagine
ME658612
-
CA1214
-
-
N-ALPHA-ACETYL-L-LYSINE
N(2)-Acetyllysine
ME658613
92907
CA1219
-
-
3,4-DIHYDROXYPHENYL GLYCOL
3,4-Dihydroxyphenylglycol
ME658348
91528
CA1222
-
-
OLEAMIDE
Oleamide
ME658630
5283387
CA1223
-
-
METHYL INDOLE-3-ACETATE
Indole-3-methyl acetate
ME658584
74706
CA1231
-
-
3BETA-HYDROXY-5ALPHA-PREGNAN-20-ONE
3beta-Hydroxy-5alpha-pregnan-20-one
ME658366
92787
CA1234
-
-
3-ALPHA,11-BETA,17-ALPHA,21-TETRAHYDROXY- 5-ALPHA-...
Tetrahydrocortisol
ME658354
5864
CA1235
-
-
DI-TERT-BUTYL DICARBONATE
Tert-butoxycarbonyl anhydride
ME658481
90495
CA1253
-
-
CIS-7,10,13,16-DOCOSATETRAENOIC ACID
Adrenic acid
ME658450
5497181
CA1260
-
-
METHYL ACETOACETATE
Methylacetoacetic acid
ME658582
7757
CA1265
-
-
PROMETRYN
Prometryn
ME658668
4929
CA1277
-
-
P-BENZOQUINONE
Quinone
ME658637
4650
CA1285
-
-
DIMETHYL MALEATE
Dimethyl maleate
ME658491
12215
CA1310
-
-
3-METHYL-2-OXINDOLE
3-Methyloxindole
ME658363
150923
CA1325
-
-
N-CYCLOHEXYLSULFAMIC ACID
Cyclamic acid
ME658617
7533
CA1328
-
-
BOC-MET-OH
-
ME658432
-
CA1332
-
-
BOC-ALA (+NA)
-
ME658425
-
CA1333
-
-
BOC-ALA-OH
-
ME658426
-
CA1333
-
-
BOC-PHE-OH
-
ME658433
-
CA1334
-
-
BOC-PRO-OH
-
ME658434
-
CA1335
-
-
BOC-HIS-OH
-
ME658430
-
CA1336
-
-
ETHYL 4-OXOCYCLOHEXANECARBOXYLATE
Ethyl 4-oxocyclohexanecarboxylate
ME658514
317638
CA1342
-
-
GLYCOLITHOCHOLIC ACID ETHYL ESTER
-
ME658536
-
CA1349
-
-
BOC-ASP-OH
-
ME658428
-
CA1350
-
-
METHYL PARABEN
Methylparaben
ME658586
7456
CA1357
-
-
3-METHOXY-L-TYROSINE
3-Methoxytyrosine
ME658361
9307
CA1364
-
-
ETHYLMALONIC ACID
Ethylmalonic acid
ME658515
11756
CA1366
-
-
1-OLEOYL-RAC-GLYCEROL
MG 18:1
ME658324
5319879
CA1373
-
-
1,2-DIDECANOYL-SN-GLYCERO-3-PHOSPHOCHOLINE
PC 10:0/10:0
ME658320
-
CA1375
-
-
NORMETANEPHRINE
Normetanephrine
ME658624
1237
CA1379
-
-
THREONINE (*)
Threonine
ME658714
6288
CA1381
-
-
URDINE 5`-DIPHOSPHO-N-ACETYLGALACTOSAMINE
-
ME658729
-
CA1401
-
-
GLYCERALDEHYDE 3-PHOSPHATE DIETHYL ACETAL
Glyceraldehyde 3-phosphate diethyl acetal
ME658531
-
CA1402
-
-
SELENOCYSTAMINE
Selenocystamine
ME658692
-
CA1403
-
-
6-HYDROXYDOPAMINE
6-Hydroxydopamine
ME658393
4624
CA1404
-
-
LAUROYLCARNITINE
CAR 12:0
ME658569
10427569
CA1406
-
-
4-HYDROXY-3-METHOXYPHENYLGLYCOL
Vanylglycol
ME658375
10805
CA1410
-
-
SORBIC ACID
Sorbic acid
ME658696
643460
CA1411
-
-
MONO-ETHYL MALONATE
Monoethyl malonic acid
ME658593
70615
CA1417
-
-
GAMMA-BUTYROLACTONE
gamma-Butyrolactone
ME658520
7302
CA1420
-
-
BOC-SER-OH
-
ME658435
-
CA1423
-
-
BOC-LYS-OH
-
ME658431
-
CA1424
-
-
N-BOC-D-GLUCOSAMINE
Glucosamine
ME658615
-
CA1426
-
-
N-ACETYL-DL-GLUTAMIC ACID
N-Acetylglutamic acid
ME658601
70914
CA1454
-
-
P-BROMO-DL-PHENYLALANINE
P-Bromo-DL-phenylalanine
ME658638
85681
CA1463
-
-
OPHTHALMIC ACID
Ophthalmic acid
ME658633
7018721
CA1475
-
-
PARAOXON-METHYL
Paraoxon-methyl
ME658645
13708
CA1476
-
-
N-NITROSODIETHANOLAMINE
N-Nitrosodiethanolamine
ME658619
14223
CA1477
-
-
METHYL VANILLATE
Methyl vanillate
ME658587
19844
CA1479
-
-
2-HYDROXY-4-(METHYLTHIO)BUTYRIC ACID
2-Hydroxy-4-(methylthio)butanoic acid
ME658333
11427
CA1484
-
-
DIETHYL AMINOMALONATE
Diethyl aminomalonate
ME658486
81272
CA1488
-
-
4-AMINOBENZOYLGLUTAMIC ACID
4-Aminobenzoylglutamic acid
ME658370
65138
CA1491
-
-
PENTOPYRANOSE
Pentopyranose
ME658649
641630
CA1493
-
-
O-PHOSPHONOHEXOPYRANOSE
-
ME658627
-
CA1494
-
-
DIHEXOSE
-
ME658487
-
CA1495
-
-
ADENOSINE DIPHOSPHATE
ADP
ME658400
6022
CA1496
-
-
N-ACETYL-D-HEXOSAMINE
N-Acetylhexosamine
ME658599
-
CA1500
-
-
2-AMINO-2-DEOXYHEXOPYRANOSE
-
ME658330
-
CA1504
-
-
DIMETHYLXANTHINE
-
ME658495
-
CA1507
-
-
DIMETHYLXANTHINE (*)
-
ME658496
-
CA1507
-
-
AMINOHYDROXYBUTANOIC ACID
-
ME658407
-
CA1508
-
-
PYRIDINE CARBOXYLIC ACID
-
ME658672
-
CA1509
-
-
HEXITOL
Sorbitol
ME658542
453
CA1510
-
-
PENTITOL
Arabitol
ME658648
827
CA1511
-
-
AMINOHYDROXYBENZOIC ACID
Aminohydroxybenzoic acid
ME658406
-
CA1514
-
-
DIHYDROXYBENZOIC ACID
Dihydroxybenzoic acid
ME658490
-
CA1515
-
-
HYDROXYBENZALDEHYDE
Hydroxybenzaldehyde
ME658554
6998
CA1516
-
-
HYDROXYBENZOIC ACID
Hydroxybenzoic acid
ME658555
135
CA1517
-
-
BENZENEDICARBOXYLIC ACID
-
ME658417
-
CA1518
-
-
[13C]-LYSINE
Lysine
ME658747
5962
CA1684
-
-
[13C]-ARGININE
Arginine
ME658742
6322
CA1719
-
-
[13C]-THREONINE
Threonine
ME658751
6288
CA1727
-
-
[13C]-GLUTAMATE
Glutamic acid
ME658744
-
CA1731
-
-
[13C]-ASPARTIC ACID
Aspartic acid
ME658743
5960
CA1745
-
-
[13C]-PROLINE
Proline
ME658750
145742
CA1754
-
-
[13C]-VALINE
Valine
ME658753
6287
CA1779
-
-
[13C]-METHIONINE
Methionine
ME658748
6137
CA1790
-
-
[13C]-TYROSINE
Tyrosine
ME658752
6057
CA1825
-
-
[13C]-ISOLEUCINE
Isoleucine
ME658745
6306
CA1831
-
-
[13C]-LEUCINE
Leucine
ME658746
6106
CA1831
-
-
[13C]-PHENYLALANINE
Phenylalanine
ME658749
6140
CA1855
-
-
ARG-VAL-TRP
Arg-Val-Trp
ME658412
-
CA1890
-
-
N-ACETYL-L-CYSTEINE
N-Acetylcysteine
ME658605
12035
CE1310
-
-
N-ACETYL-L-ALANINE
N-Acetylalanine
ME658603
88064
CE1554
-
-
DIACYLGLYCEROPHOSPHOGLYCEROL (*)
-
ME658484
-
K00037
-
-
DOCOSAHEXAENOYLGLYCEROPHOSPHOETHANOLAMINE (*)
-
ME658501
-
K01455
-
-
PYROGLUTAMINE (*)
Pyroglutamine
ME658677
134508
K01750
-
-
CERAMIDE PHOSPHOCHOLINE (*)
SM 18:0;O2/22:1
ME658471
-
K02047
-
-
LINOLEOYLGLYCEROPHOSPHOCHOLINE (*)
LPC 18:2
ME658573
-
K02239
-
-
BUTYRYLCARNITINE (*)
CAR 4:0
ME658439
213144
K07954
-
-
TIGLYL CARNITINE (*)
CAR 4:1;2Me
ME658717
22833596
K08128
-
-
STEAROYLCARNITINE (*)
CAR 18:0
ME658706
52922056
K08129
-
-
ISOVALERYLCARNITINE (*)
CAR 4:0;3Me
ME658566
6426851
K08149
-
-
PENTADECANOYLGLYCEROPHOSPHOCHOLINE/STEAROYLGLYCERO...
-
ME658647
-
K08217
-
-
DOCOSAPENTAENOYLGLYCEROPHOSPHOCHOLINE
LPC 22:5
ME658502
-
K08312
-
-
STEAROYLGLYCEROPHOSPHOCHOLINE (*)
LPC 18:0
ME658707
-
K08377
-
-
EICOSATRIENOYLGLYCEROPHOSPHOCHOLINE (*)
-
ME658506
-
K08397
-
-
GAMMA-GLUTAMYLMETHIONINE (*)
gamma-Glutamylmethionine
ME658522
-
K08579
-
-
PALMITOYL SPHINGOMYELIN (*)
SM 18:1;O2/16:0
ME658640
9939941
K08639
-
-
GAMMA-GLUTAMYLPHENYLALANINE (*)
gamma-Glutamylphenylalanine
ME658523
111299
K08879
-
-
GLUTAROYL CARNITINE (*)
CAR DC5:0
ME658529
53481622
K09042
-
-
PALMITOLEOYLGLYCEROPHOSPHOCHOLINE (*)
LPC 16:1
ME658639
-
K09130
-
-
DIMETHYLGUANOSINE (*)
Dimethylguanosine
ME658494
-
K09146
-
-
CIS-4-DECENOYL CARNITINE (*)
CAR 10:1
ME658449
57357170
K09179
-
-
GAMMA-GLUTAMYLISOLEUCINE (*)
gamma-Glutamylisoleucine
ME658521
14253342
K09236
-
-
DOCOSAHEXAENOYLGLYCEROPHOSPHOCHOLINE (*)
LPE 22:6
ME658500
-
K09469
-
-
3-(CYSTEIN-S-YL)ACETAMINOPHEN (*)
3-(Cystein-S-yl)acetaminophen
ME658353
-
K10359
-
-
CINNAMOYLGLYCINE (*)
Cinnamoylglycine
ME658448
709625
K10610
-
-
DECANOYLCARNITINE (*)
CAR 10:0
ME658473
11953821
K10936
-
-
COTININE (*)
Cotinine
ME658459
408
K10998
-
-
METHYLGLUTAROYLCARNITINE (*)
CAR DC5:0;3Me
ME658588
-
K11239
-
-
N4-ACETYLCYTIDINE (*)
N4-Acetylcytidine
ME658621
107461
K11647
-
-
METHIONYLALANINE (*)
Met-Ala
ME658581
7009581
K13270
-
-
GAMMA-GLUTAMYLTYROSINE (*)
gamma-Glutamyltyrosine
ME658524
94340
K14770
-
-
C-GLYCOSYLTRYPTOPHAN (*)
C-Glycosyltryptophan
ME658440
-
K87470
-
-
LEUCYLPHENYLALANINE (*)
Leu-Phe
ME658572
6992310
K87920
-
-
CINNAMOYLGLYCINE (*)
Cinnamoylglycine
ME658447
-
K88537
-
-
OLEOYLCARNITINE (*)
CAR 18:1
ME658631
6441392
K88838
-
-
PRO-HYDROXY-PRO (*)
Pro-hydroxyPro
ME658665
11902892
K96372
-
-
POSSIBLE L-LEUCYL-L-LEUCINE
-
ME658662
-
U03237
-
-
DI-LINOLEOYL-3-SN-PHOSPHATIDYLCHOLINE (POSSIBLY)
-
ME658479
-
UP0002
-
-
DIACYL-PHOSPHATIDYLCHOLINE
-
ME658483
-
UP0012
-
-
DI-LINOLEOYL-3-SN-PHOSPHATIDYLCHOLINE (PROBABLY)
-
ME658480
-
UP0013
-
-
DIACYL-GLYCEROPHOSPHOCHOLINE (C50H82NO8P PROBABLY)
-
ME658482
-
UP0027
-
-
DIOLEOYLPHOSPHATIDYLCHOLINE
PC 18:1/18:1
ME658497
-
Z02138
-
-
Analysis: ESI negative ion mode
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
NADP
NADP+
ME659031
5886
C00006
-
-
ADENOSINE 5`-DIPHOSPHATE
ADP
ME658836
6022
C00008
-
-
PHOSPHATE
Phosphoric acid
ME659066
1004
C00009
-
-
COENZYME A
Coenzyme A
ME658893
87642
C00010
-
-
URIDINE 5`-DIPHOSPHATE
UDP
ME659130
6031
C00015
-
-
FLAVIN ADENINE DINUCLEOTIDE
FAD
ME658935
643975
C00016
-
-
ADENOSINE 5`-MONOPHOSPHATE
AMP
ME658837
6083
C00020
-
-
S-ADENOSYL-L-HOMOCYSTEINE
S-Adenosylhomocysteine
ME659092
439155
C00021
-
-
PYRUVATE
Pyruvic acid
ME659085
1060
C00022
-
-
ALPHA-KETO-GLUTARATE
2-Oxoglutaric acid
ME658841
51
C00026
-
-
URIDINE 5`-DIPHOSPHOGLUCOSE
UDP-glucose
ME659131
53477679
C00029
-
-
GUANOSINE 5`-DIPHOSPHATE
GDP
ME658957
8977
C00035
-
-
SUCCINATE
Succinic acid
ME659107
1110
C00042
-
-
GUANOSINE 5`-TRIPHOSPHATE
GTP
ME658958
6830
C00044
-
-
GLYOXYLATE
Glyoxylic acid
ME658953
760
C00048
-
-
CYTIDINE 5`-TRIPHOSPHATE
CTP
ME658906
6176
C00063
-
-
THIAMINE PYROPHOSPHATE
Thiamine diphosphate
ME659115
1132
C00068
-
-
PHOSPHO(ENOL)PYRUVIC ACID
Phosphoenolpyruvic acid
ME659067
1005
C00074
-
-
URIDINE 5`-TRIPHOSPHATE
UTP
ME659132
6133
C00075
-
-
TRYPTOPHAN (*)
Tryptophan
ME659124
6305
C00078
-
-
INOSINE 5`-TRIPHOSPHATE
ITP
ME658984
8583
C00081
-
-
CATECHOL
Pyrocatechol
ME658881
289
C00090
-
-
INOSINE 5`-DIPHOSPHATE
IDP
ME658982
6831
C00104
-
-
URACIL
Uracil
ME659127
1174
C00106
-
-
ANTHRANILATE
2-Aminobenzoic acid
ME658850
227
C00108
-
-
DIHYDROXYACETONE PHOSPHATE
Dihydroxyacetone phosphate
ME658918
668
C00111
-
-
CYTIDINE 5`-DIPHOSPHATE
CDP
ME658904
6132
C00112
-
-
RIBOSE 5-PHOSPHATE
Ribose 5-phosphate
ME659090
439167
C00117
-
-
5-PHOSPHO-ALPHA-D-RIBOSE
Phosphoribosyl pyrophosphate
ME658824
7339
C00119
-
-
BIOTIN
Biotin
ME658864
171548
C00120
-
-
FUMARIC ACID
Fumaric acid
ME658938
444972
C00122
-
-
INOSINE 5`-MONOPHOSPHATE
IMP
ME658983
8582
C00130
-
-
MYO-INOSITOL
Myo-inositol
ME659005
892
C00137
-
-
GUANOSINE 5` MONOPHOSPHATE
GMP
ME658956
6804
C00144
-
-
ADENINE
Adenine
ME658833
190
C00147
-
-
NICOTINAMIDE
Niacinamide
ME659033
936
C00153
-
-
CITRATE
Citric acid
ME658891
311
C00158
-
-
PHENYLPYRUVATE
Phenylpyruvic acid
ME659065
997
C00166
-
-
5`-METHYLTHIOADENOSINE
5'-Methylthioadenosine
ME658825
439176
C00170
-
-
NONADECENOATE (*)
Nonadecenoic acid
ME659036
-
C00174
-
-
THYMINE
Thymine
ME659119
1135
C00178
-
-
BENZOATE
Benzoic acid
ME658861
243
C00180
-
-
LACTATE (*)
Lactic acid
ME658987
107689
C00186
-
-
(S)-LACTATE
Lactic acid
ME658755
107689
C00186
-
-
CHOLESTEROL (*)
Cholesterol
ME658884
5997
C00187
-
-
2,3-DIHYDROXYBENZOATE
2-Pyrocatechuic acid
ME658762
19
C00196
-
-
2`-DEOXYADENOSINE 5`-DIPHOSPHATE
dADP
ME658775
188966
C00206
-
-
OXALATE
Oxalic acid
ME659050
971
C00209
-
-
ADENOSINE
Adenosine
ME658834
60961
C00212
-
-
THYMIDINE
Thymidine
ME659118
5789
C00214
-
-
ARACHIDONATE
Arachidonic acid
ME658852
444899
C00219
-
-
3,4-DIHYDROXYBENZOATE
Protocatechuic acid
ME658780
72
C00230
-
-
2`-DEOXYCYTIDINE 5`-MONOPHOSPHATE
dCMP
ME658778
13945
C00239
-
-
TAURINE
Taurine
ME659109
1123
C00245
-
-
LIPOAMIDE
Lipoamide
ME658994
863
C00248
-
-
PALMITIC ACID
Palmitic acid
ME659054
985
C00249
-
-
PYRIDOXAL
Pyridoxal
ME659083
1050
C00250
-
-
RIBOFLAVIN
Riboflavin
ME659089
493570
C00255
-
-
GLYCERIC ACID
Glyceric acid
ME658947
439194
C00258
-
-
HYPOXANTHINE
Hypoxanthine
ME658975
790
C00262
-
-
N-ACETYLNEURAMINATE
N-Acetylneuraminic acid
ME659020
439197
C00270
-
-
EDTA (*)
Edetic acid
ME658928
6049
C00284
-
-
ETHYLENEDIAMINETETRAACETIC (EDTA) ACID
Edetic acid
ME658933
6049
C00284
-
-
INOSINE
Inosine
ME658981
6021
C00294
-
-
OROTATE
Orotic acid
ME659049
967
C00295
-
-
QUINATE
Quinic acid
ME659086
6508
C00296
-
-
URIDINE
Uridine
ME659129
6029
C00299
-
-
CREATINE
Creatine
ME658896
586
C00300
-
-
GLUTAMIC ACID
Glutamic acid
ME658944
33032
C00302
-
-
GLUTAMINE
Glutamine
ME658945
5961
C00303
-
-
CYTIDINE 5`-DIPHOSPHOCHOLINE
CDP-choline
ME658905
13804
C00307
-
-
PYRIDOXINE
Pyridoxine
ME659084
1054
C00314
-
-
2-OXOADIPATE
Oxoadipic acid
ME658771
71
C00322
-
-
CITRULLINE
Citrulline
ME658892
9750
C00327
-
-
(S)-DIHYDROOROTATE
4,5-Dihydroorotic acid
ME658754
648
C00337
-
-
6-PHOSPHOGLUCONIC ACID
6-Phosphogluconic acid
ME658828
91493
C00345
-
-
PHOSPHOETHANOLAMINE
Phosphoethanolamine
ME659069
1015
C00346
-
-
GLUCOSAMINE 6-PHOSPHATE
Glucosamine 6-phosphate
ME658942
439217
C00352
-
-
GERANYL PYROPHOSPHATE
Geranyl diphosphate
ME658940
447277
C00353
-
-
FRUCTOSE 1,6-BIPHOSPHATE
Fructose 1,6-bisphosphate
ME658937
172313
C00354
-
-
URATE
Uric acid
ME659128
1175
C00366
-
-
MALONATE
Malonic acid
ME658998
867
C00383
-
-
XANTHINE
Xanthine
ME659136
1188
C00385
-
-
CARNOSINE
Carnosine
ME658880
439224
C00386
-
-
GUANOSINE
Guanosine
ME658955
6802
C00387
-
-
ISOLEUCINE/LEUCINE (*)
Leucine/Isoleucine
ME658985
6306
C00407
-
-
PROGESTERONE
Progesterone
ME659076
5994
C00410
-
-
ACONITATE (*)
trans-Aconitic acid
ME658832
444212
C00417
-
-
5,6-DIHYDROURACIL
Dihydrouracil
ME658817
649
C00429
-
-
5-AMINOLEVULINIC ACID
5-Amino-levulinic acid
ME658819
137
C00430
-
-
2`-DEOXYURIDINE 5`-TRIPHOSPHATE
UTP
ME658779
6133
C00460
-
-
PURINE
Purine
ME659080
1044
C00465
-
-
ESTRONE
Estrone
ME658932
5870
C00468
-
-
TYRAMINE
Tyramine
ME659126
5610
C00483
-
-
GLUTARATE
Glutaric acid
ME658946
743
C00489
-
-
RAFFINOSE
Raffinose
ME659087
439242
C00492
-
-
SHIKIMATE
Shikimic acid
ME659101
8742
C00493
-
-
BILIVERDIN
Biliverdin
ME658863
5280353
C00500
-
-
XYLONATE (*)
Xylonic acid
ME659140
6602431
C00502
-
-
ERYTHRITOL
Erythritol
ME658930
222285
C00503
-
-
CYSTEIC ACID
Cysteic acid
ME658901
72886
C00506
-
-
ORNITHINE
Ornithine
ME659048
6262
C00515
-
-
HYPOTAURINE
Hypotaurine
ME658974
107812
C00519
-
-
PANTOATE
(R)-Pantoic acid
ME659059
439251
C00522
-
-
DEOXYURIDINE
Deoxyuridine
ME658911
13712
C00526
-
-
TESTOSTERONE
Testosterone
ME659113
6013
C00535
-
-
CYSTATHIONINE
Cystathionine
ME658900
439258
C00542
-
-
2`-DEOXYADENOSINE
Deoxyadenosine
ME658774
13730
C00559
-
-
4-AMINOBENZOATE
p-Aminobenzoic acid
ME658803
978
C00568
-
-
ADENOSINE 3`,5`-CYCLIC MONOPHOSPHATE
3',5' cyclic AMP
ME658835
6076
C00575
-
-
GUANIDINOACETATE
Guanidoacetic acid
ME658954
763
C00581
-
-
CHOLINE PHOSPHATE
Choline phosphate
ME658886
135437
C00588
-
-
PHENYLACETALDEHYDE
Phenylacetaldehyde
ME659062
998
C00601
-
-
3-SULFINO-L-ALANINE
3-Sulfino-alanine
ME658799
1549098
C00606
-
-
3-HYDROXYANTHRANILATE
3-Hydroxyanthranilic acid
ME658789
86
C00632
-
-
4-HYDROXYBENZALDEHYDE
4-Hydroxybenzaldehyde
ME658812
126
C00633
-
-
INDOLE-3-ACETALDEHYDE
Indoleacetaldehyde
ME658977
800
C00637
-
-
4-HYDROXYPHENYLACETATE
4-Hydroxyphenyl acetate
ME658813
127
C00642
-
-
5-HYDROXY-L-TRYPTOPHAN
5-Hydroxy-tryptophan
ME658820
439280
C00643
-
-
XANTHOSINE 5`-MONOPHOSPHATE
XMP
ME659138
73323
C00655
-
-
LL-2,6-DIAMINOHEPTANEDIOATE
2,6-Diaminopimelic acid
ME658995
1549100
C00666
-
-
SN-GLYCERO-3-PHOSPHOCHOLINE
sn-Glycero-3-phosphocholine
ME659102
657272
C00670
-
-
CHOLATE
Cholic acid
ME658883
221493
C00695
-
-
2`-DEOXYCYTIDINE 5`-DIPHOSPHATE
dCDP
ME658777
150855
C00705
-
-
MALATE
Malic acid
ME658997
222656
C00711
-
-
OLEATE
Oleic acid
ME659045
445639
C00712
-
-
SERINE
Serine
ME659100
5951
C00716
-
-
[C13] VALINE
Valine
ME659144
6287
C00719
-
-
RETINOATE
Retinoic acid
ME659088
444795
C00777
-
-
UROCANATE
Urocanic acid
ME659133
1549103
C00785
-
-
SALICYLATE (*)
Salicylic acid
ME659096
338
C00805
-
-
4-COUMARATE
cis-p-Coumaric acid
ME658805
637542
C00811
-
-
OXOMALONATE
Mesoxalic acid
ME659051
10132
C00830
-
-
4-PYRIDOXATE
4-Pyridoxic acid
ME658815
6723
C00847
-
-
PANTOTHENIC ACID
Pantothenic acid
ME659060
988
C00864
-
-
4-NITROPHENOL
4-Nitrophenol
ME658814
980
C00870
-
-
2`-DEOXYCYTIDINE
Deoxycytidine
ME658776
13711
C00881
-
-
3-METHYLADENINE
3-Methyladenine
ME658797
1673
C00913
-
-
ESTRADIOL-17BETA
beta-Estradiol
ME658931
5757
C00951
-
-
INDOLE-3-ACETIC ACID
Indoleacetic acid
ME658978
802
C00954
-
-
INDOLE-3-ETHANOL
Tryptophanol
ME658979
10685
C00955
-
-
MERCAPTOPYRUVATE
3-Mercaptopyruvic acid
ME659000
98
C00957
-
-
TRYPTOPHANAMIDE
Tryptophanamide
ME659125
439356
C00977
-
-
N-ACETYLSEROTONIN
N-Acetylserotonin
ME659021
903
C00978
-
-
6-HYDROXYNICOTINATE
6-Hydroxynicotinic acid
ME658827
72924
C01020
-
-
4-GUANIDINOBUTANOIC ACID
4-Guanidinobutanoic acid
ME658806
500
C01035
-
-
THIAMIN MONOPHOSPHATE
Thiamine monophosphate
ME659114
3382778
C01081
-
-
3-HYDROXYBUTANOIC ACID
3-Hydroxybutyric acid
ME658792
441
C01089
-
-
O-SUCCINYL-L-HOMOSERINE
o-Succinylhomoserine
ME659042
439406
C01118
-
-
N-ACETYL-D-GALACTOSAMINE
N-Acetyl-D-galactosamine
ME659011
35717
C01132
-
-
N(PAI)-METHYL-L-HISTIDINE
3-Methylhistidine
ME659008
64969
C01152
-
-
N(PAI)-METHYL-L-HISTIDINE (*)
3-Methylhistidine
ME659009
64969
C01152
-
-
2,3-DIPHOSPHO-D-GLYCERIC ACID
2,3-Diphosphoglyceric acid
ME658763
186004
C01159
-
-
17ALPHA-HYDROXYPROGESTERONE
17alpha-Hydroxyprogesterone
ME658759
6238
C01176
-
-
3-(2-HYDROXYPHENYL)PROPANOATE
3-(2-Hydroxyphenyl)propanoic acid
ME658783
873
C01198
-
-
PHYTIC ACID
Myo-inositol hexakisphosphate
ME659073
890
C01204
-
-
1-AMINOCYCLOPROPANE-1-CARBOXYLATE
1-Aminocyclopropanecarboxylic acid
ME658757
535
C01234
-
-
B-ALANYL-N(PAI)-METHYL-L-HISTIDINE
Anserine
ME658859
112072
C01262
-
-
BENZOIN
Benzoin
ME658862
8400
C01408
-
-
BOC-ASN-OH
-
ME658869
82035
C01410
-
-
CYS-GLY
Cys-Gly
ME658899
439498
C01419
-
-
CYSTINE
Cystine
ME658902
595
C01420
-
-
FERULATE
trans-Ferulic acid
ME658934
445858
C01494
-
-
STEARATE
Stearic acid
ME659104
5281
C01530
-
-
TARTARIC ACID
Tartaric acid
ME659108
444305
C01534
-
-
[C13] TYROSINE
Tyrosine
ME659143
6057
C01536
-
-
ALLANTOIN
Allantoin
ME658840
204
C01551
-
-
DECANOATE
Capric acid
ME658907
2969
C01571
-
-
HEXANOATE
Caproic acid
ME658965
8892
C01585
-
-
HIPPURATE
Hippuric acid
ME658968
464
C01586
-
-
LINOLEATE
Linoleic acid
ME658992
5280450
C01595
-
-
MELATONIN
Melatonin
ME658999
896
C01598
-
-
NONANOATE
Pelargonic acid
ME659037
8158
C01601
-
-
PHTHALATE
Phthalic acid
ME659072
1017
C01606
-
-
STACHYOSE
Stachyose
ME659103
439531
C01613
-
-
THREONATE (*)
Threonic acid
ME659117
151152
C01620
-
-
4-HYDROXY-2-QUINOLINECARBOXYLIC ACID
Kynurenic acid
ME658807
3845
C01717
-
-
KYNURENINE
Kynurenine
ME658986
161166
C01718
-
-
LUMICHROME
Lumichrome
ME658996
5326566
C01727
-
-
[C13] METHIONINE
Methionine
ME659141
6137
C01733
-
-
METHIONINE
Methionine
ME659001
6137
C01733
-
-
XANTHOSINE
Xanthosine
ME659137
64959
C01762
-
-
ALDOSTERONE
Aldosterone
ME658839
5839
C01780
-
-
DEOXYRIBOSE
Deoxyribose
ME658910
9828112
C01801
-
-
THYROXINE
Thyroxine
ME659121
5819
C01829
-
-
5-OXO-PROLINE
Pyroglutamic acid
ME658823
499
C01879
-
-
DETHIOBIOTIN
Dethiobiotin
ME658913
445027
C01909
-
-
GLYCOCHOLATE
Glycocholic acid
ME658950
10140
C01921
-
-
PREGNENOLONE
Pregnenolone
ME659075
8955
C01953
-
-
2-HYDROXYPHENYLACETIC ACID
2-Hydroxyphenylacetic acid
ME658768
11914
C01983
-
-
2-AMINOPHENOL
2-Aminophenol
ME658766
5801
C01987
-
-
[C13] PHENYLALANINE
Phenylalanine
ME659142
6140
C02057
-
-
PHENYLALANINE
Phenylalanine
ME659064
6140
C02057
-
-
CORTICOSTERONE
Corticosterone
ME658894
5753
C02140
-
-
PHOSPHOCREATINE
Phosphocreatine
ME659068
587
C02305
-
-
CYTIDINE 2`,3`-CYCLIC MONOPHOSPHATE
2',3' cyclic CMP
ME658903
68934
C02354
-
-
ARGININE
Arginine
ME658855
6322
C02385
-
-
XANTHURENIC ACID
Xanthurenic acid
ME659139
5699
C02470
-
-
ALPHA-TOCOPHEROL (*)
alpha-Tocopherol
ME658842
14985
C02477
-
-
CHENODEOXYCHOLATE
Chenodeoxycholic acid
ME658882
10133
C02528
-
-
O-ACETYL-L-CARNITINE
CAR 2:0
ME659039
1
C02571
-
-
TAUROLITHOCHOLATE
Taurolithocholic acid
ME659112
439763
C02592
-
-
3-DEHYDROSHIKIMATE
3-Dehydroshikimate
ME658786
439774
C02637
-
-
6-CARBOXYHEXANOATE
Pimelic acid
ME658826
385
C02656
-
-
GLUCURONOLACTONE
Glucuronolactone
ME658943
439782
C02670
-
-
DODECANEDIOATE (*)
Dodecanedioic acid
ME658926
12736
C02678
-
-
LAURIC ACID
Lauric acid
ME658988
3893
C02679
-
-
N-ACETYL-L-LEUCINE
N-Acetylleucine
ME659017
75619
C02710
-
-
2,5-DIOXOPIPERAZINE
Cyclo(Gly-Gly)
ME658765
7817
C02777
-
-
3-HYDROXY-DL-KYNURENINE
Hydroxykynurenine
ME658788
89
C02794
-
-
ACENAPHTHENEQUINONE
Acenaphthenequinone
ME658830
6724
C02807
-
-
CORTISOL 21-ACETATE
Cortisol 21-acetate
ME658895
5744
C02821
-
-
S-HEXYL-GLUTATHIONE
S-Hexyl-glutathione
ME659094
97536
C02886
-
-
4-ACETAMIDOBUTANOATE
4-Acetamidobutanoic acid
ME658802
18189
C02946
-
-
2-HYDROXYSTEARATE (*)
2-Hydroxystearic acid
ME658770
439887
C03045
-
-
3-HYDROXYBENZALDEHYDE
3-Hydroxybenzaldehyde
ME658790
101
C03067
-
-
5-HYDROXYMETHYLURACIL
5-Hydroxymethyluracil
ME658822
78168
C03088
-
-
DIMETHYLBENZIMIDAZOLE
Dimethylbenzimidazole
ME658919
675
C03114
-
-
N-ACETYL-D-TRYPTOPHAN
N-Acetyl-D-tryptophan
ME659012
439917
C03137
-
-
FORMYL-L-METHIONINE
N-Formylmethionine
ME658936
6995182
C03145
-
-
2,4-DIHYDROXYPTERIDINE
Lumazine
ME658764
10250
C03212
-
-
DIHOMO-LINOLENATE (*)
-
ME658917
6439848
C03242
-
-
ACETYLENEDICARBOXYLATE
Acetylenedicarboxylate
ME658831
371
C03248
-
-
3-HYDROXYBENZYL ALCOHOL
3-Hydroxybenzyl alcohol
ME658791
102
C03351
-
-
3-METHYL-2-OXOVALERIC ACID
3-Methyl-2-oxovaleric acid
ME658796
47
C03465
-
-
N-ACETYL-L-PHENYLALANINE
N-Acetylphenylalanine
ME659018
74839
C03519
-
-
THIOPURINE S-METHYLETHER
6-Methylthiopurine
ME659116
5778
C03542
-
-
METHYL BETA-D-GALACTOSIDE
Methyl beta-D-galactoside
ME659002
94214
C03619
-
-
2`,4`-DIHYDROXYACETOPHENONE
2',4'-Dihydroxyacetophenone
ME658773
6990
C03663
-
-
3-(4-HYDROXYPHENYL)LACTATE
Hydroxyphenyllactic acid
ME658784
9378
C03672
-
-
N-BENZYLOXYCARBONYLGLYCINE
N-Benzyloxycarbonylglycine
ME659024
14349
C03710
-
-
PYRIDINE-2,3-DICARBOXYLATE
Quinolinic acid
ME659082
1066
C03722
-
-
S-CARBOXYMETHYL-L-CYSTEINE
S-Carboxymethyl-cysteine
ME659093
193653
C03727
-
-
GLUCOSAMINATE
Glucosaminic acid
ME658941
73563
C03752
-
-
3-HYDROXY-3-METHYLGLUTARATE
3-Hydroxymethylglutaric acid
ME658787
1662
C03761
-
-
17BETA-HYDROXYANDROSTAN-3-ONE
5alpha-Dihydrotesosterone
ME658760
10635
C03917
-
-
THYROTROPIN RELEASING HORMONE
Thyrotropin releasing hormone
ME659120
638678
C03958
-
-
3ALPHA-HYDROXY-5BETA-CHOLANATE
Lithocholic acid
ME658800
9903
C03990
-
-
DIETHYL 2-METHYL-3-OXOSUCCINATE
4-Heptenal diethyl acetal
ME658914
97750
C04067
-
-
N6-(DELTA2-ISOPENTENYL)-ADENINE
N6-Isopentenyladenine
ME659030
92180
C04083
-
-
3,5-DIBROMO-4-HYDROXYBENZONITRILE
3,5-Dibromo-4-hydroxybenzonitrile
ME658782
15531
C04178
-
-
OCTOPAMINE
Octopamine
ME659044
440266
C04227
-
-
4-ANDROSTEN-3BETA,17BETA-DIOL DISULFATE (*)
4-Androsten-3beta,17beta-diol disulfate
ME658804
10634
C04295
-
-
ANDROSTERONE SULFATE (*)
5alpha-Androstane-3alpha-ol-17-one sulfate
ME658848
10634
C04295
-
-
3BETA-HYDROXYANDROST-5-EN-17-ONE 3-SULFATE
Dehydroepiandrosterone sulfate
ME658801
12594
C04555
-
-
LEUCENOL
Mimosine
ME658990
440473
C04771
-
-
TAUROCHOLATE (*)
Taurocholic acid
ME659111
6675
C05122
-
-
11-BETA-HYDROXYANDROST-4-ENE-3,17-DIONE
11beta-Hydroxyandrost-4-ene-3,17-dione
ME658758
94141
C05284
-
-
SELENOMETHIONINE
Selenomethionine
ME659099
15103
C05335
-
-
GULONO-1,4-LACTONE
D-Gulonolactone
ME658959
165105
C05410
-
-
GLYCOCHENODEOXYCHOLATE / GLYCODEOXYCHOLATE (*)
Glycodeoxycholic acid
ME658949
22833539
C05464
-
-
GLYCODEOXYCHOLATE / GLYCOCHENODEOXYCHOLATE (*)
Glycodeoxycholic acid
ME658951
22833539
C05464
-
-
TAUROCHENODEOXYCHOLATE (*)
Taurochenodeoxycholic acid
ME659110
387316
C05465
-
-
HOMOVANILLATE
Homovanillic acid
ME658969
1738
C05582
-
-
4-HYDROXY-3-METHOXYMANDELIC ACID
-
ME658809
736172
C05584
-
-
3-METHOXYTYRAMINE
3-Methoxytyramine
ME658794
1669
C05587
-
-
4-VINYLPHENOL SULFATE (*)
4-Hydroxystyrene
ME658816
62453
C05627
-
-
5-HYDROXYINDOLE-3-ACETIC ACID
5-Hydroxyindoleacetic acid
ME658821
1826
C05635
-
-
PHOSPHONOACETATE
Phosphonoacetate
ME659071
546
C05682
-
-
VITAMIN B12
Vitamin B12
ME659135
16212801
C05776
-
-
2-HYDROXYBUTYRIC ACID
2-Hydroxybutyric acid
ME658767
11266
C05984
-
-
N-METHYLTRYPTAMINE
N-Methyltryptamine
ME659028
6088
C06213
-
-
4-HYDROXY-3-METHOXY-BENZENEMETHANOL
4-Hydroxy-3-methoxybenzenemethanol
ME658808
62348
C06317
-
-
2-QUINOLINECARBOXYLIC ACID
Quinaldic acid
ME658772
7124
C06325
-
-
2-HYDROXYQUINOLINE
2-Hydroxyquinoline
ME658769
6038
C06338
-
-
CAPRYLIC ACID
Caprylic acid
ME658879
379
C06423
-
-
MYRISTIC ACID
Myristic acid
ME659006
11005
C06424
-
-
ARACHIDIC ACID
Arachidic acid
ME658851
10467
C06425
-
-
GAMMA-LINOLENIC ACID
gamma-Linolenic acid
ME658939
5280933
C06426
-
-
DOCOSAHEXAENOIC ACID
Docosahexaenoic acid
ME658924
445580
C06429
-
-
PHENYLACETATE (*)
Phenyl acetate
ME659063
999
C07086
-
-
URSODIOL
Ursodeoxycholic acid
ME659134
31401
C07880
-
-
AZELAIC ACID
Azelaic acid
ME658858
2266
C08261
-
-
BEHENIC ACID
Behenic acid
ME658860
8215
C08281
-
-
ERUCIC ACID
cis-Erucic acid
ME658929
5281116
C08316
-
-
LIGNOCERIC ACID
Lignoceric acid
ME658991
11197
C08320
-
-
MYRISTOLEIC ACID
Myristoleic acid
ME659007
5281119
C08322
-
-
NERVONIC ACID
Nervonic acid
ME659032
5281120
C08323
-
-
PALMITOLEATE (*)
Palmitoleic acid
ME659055
445638
C08362
-
-
PALMITOLEIC ACID
Palmitoleic acid
ME659056
445638
C08362
-
-
INDICAN
Indican
ME658976
92769
C08481
-
-
CINNAMIC ACID
trans-Cinnamic acid
ME658887
5372954
C10438
-
-
ROSMARINIC ACID
Rosmarinic acid
ME659091
5281792
C10489
-
-
N-CYCLOHEXYLFORMAMIDE
N-Cyclohexylformamide
ME659025
13017
C11519
-
-
ANANDAMIDE
Arachidonoyl-EA
ME658847
5281969
C11695
-
-
CYCLOHEX-1-ENECARBOXYLIC ACID
Cyclohex-1-enecarboxylic acid
ME658898
69470
C12101
-
-
CYCLOHEPTANECARBOXYLIC ACID
Cycloheptanecarboxylic acid
ME658897
15091
C12104
-
-
CAPECITABINE
Capecitabine
ME658878
60953
C12650
-
-
NICOTINIC ACID ADENINE DINUCLEOTIDE PHOSPHATE
NAADP
ME659034
123953
C13051
-
-
DEOXYCORTICOSTERONE ACETATE
Deoxycorticosterone acetate
ME658909
5952
C14554
-
-
2,3,5,6-TETRACHLOROPHENOL
2,3,5,6-Tetrachlorophenol
ME658761
13636
C15505
-
-
STEARIDONATE (*)
Stearidonic acid
ME659105
5282837
C16300
-
-
DIMETHYLURATE (*)
1,7-Dimethyluric acid
ME658920
91611
C16356
-
-
ASPARTATE
Aspartic acid
ME658857
5960
C16433
-
-
PROLINE
Proline
ME659077
145742
C16435
-
-
ASPARAGINE
Asparagine
ME658856
6267
C16438
-
-
DOCOSAPENTAENOATE (*)
Docosapentaenoic acid
ME658925
5497182
C16513
-
-
DIHOMO-LINOLEATE (*)
11Z,14Z-Eicosadienoic acid
ME658916
6439848
C16525
-
-
DOCOSADIENOATE (*)
Docosadienoic acid
ME658923
5312554
C16533
-
-
NONADECANOATE / METHYLSTEARATE (*)
Nonadecylic acid
ME659035
12591
C16535
-
-
7-ALPHA-HYDROXY-3-OXO-4-CHOLESTENOATE (*)
7alpha-Hydroxy-3-oxo-4-cholestenoic acid
ME658829
53481411
C17337
-
-
PREGN STEROID MONOSULFATE (*)
Pregnenolone sulfate
ME659074
105074
C18044
-
-
HEXADECANEDIOATE (*)
Hexadecanedioic acid
ME658964
10459
C19615
-
-
MONO-METHYL GLUTARATE
Monomethyl glutaric acid
ME659004
73917
CA1015
-
-
ADIPIC ACID
Adipic acid
ME658838
196
CA1042
-
-
SALICYLIC ACID
Salicylic acid
ME659097
338
CA1067
-
-
5-AMINOIMIDAZOLE-4-CARBOXAMIDE-1-BETA-D-RIBOFURANO...
AICAR
ME658818
-
CA1116
-
-
CIS-11-EICOSENOIC ACID
cis-Gondoic acid
ME658889
5282768
CA1166
-
-
SALICYLAMIDE
Salicylamide
ME659095
5147
CA1193
-
-
3-NITRO-L-TYROSINE
Nitrotyrosine
ME658798
235719
CA1195
-
-
N-ACETYL-L-ASPARTIC ACID
N-Acetylaspartic acid
ME659015
65065
CA1200
-
-
BOC-GLY-OH
-
ME658871
-
CA1201
-
-
O-PHOSPHO-DL-SERINE
DL-O-Phosphoserine
ME659040
106
CA1209
-
-
N-ACETYL-DL-METHIONINE
N-Acetylmethionine
ME659014
448580
CA1210
-
-
N-ACETYLGLYCINE
N-Acetylglycine
ME659019
10972
CA1212
-
-
N-ALPHA-ACETYL-L-ASPARAGINE
N-Acetylasparagine
ME659022
-
CA1214
-
-
N-ALPHA-ACETYL-L-LYSINE
N(2)-Acetyllysine
ME659023
92907
CA1219
-
-
3,4-DIHYDROXYPHENYL GLYCOL
3,4-Dihydroxyphenylglycol
ME658781
91528
CA1222
-
-
METHYL INDOLE-3-ACETATE
Indole-3-methyl acetate
ME659003
74706
CA1231
-
-
N-OLEOYLGLYCINE
N-Oleoyl glycine
ME659029
6436908
CA1254
-
-
CIS-7,10,13,16-DOCOSATETRAENOIC ACID
Adrenic acid
ME658890
5497181
CA1260
-
-
N-FORMYLGLYCINE
N-Formylglycine
ME659027
75606
CA1268
-
-
TRICOSANOIC ACID
Tricosylic acid
ME659122
17085
CA1269
-
-
PROMETRYN
Prometryn
ME659078
4929
CA1277
-
-
PTERIN
Pterin
ME659079
73000
CA1303
-
-
3-METHYL-2-OXINDOLE
3-Methyloxindole
ME658795
150923
CA1325
-
-
N-CYCLOHEXYLSULFAMIC ACID
Cyclamic acid
ME659026
7533
CA1328
-
-
BOC-MET-OH
-
ME658873
-
CA1332
-
-
BOC-ALA-OH
-
ME658867
-
CA1333
-
-
BOC-PHE-OH
-
ME658874
-
CA1334
-
-
BOC-PRO-OH
-
ME658875
-
CA1335
-
-
BOC-HIS-OH
-
ME658872
-
CA1336
-
-
ANILINE-2-SULFONIC ACID
2-Aminobenzenesulfonic acid
ME658849
6926
CA1341
-
-
GLYCOLITHOCHOLIC ACID ETHYL ESTER
-
ME658952
-
CA1349
-
-
BOC-ASP-OH
-
ME658870
-
CA1350
-
-
HEXACOSANOIC ACID
Cerotic acid
ME658963
10469
CA1352
-
-
3-METHOXY-L-TYROSINE
3-Methoxytyrosine
ME658793
9307
CA1364
-
-
HEPTADECANOATE
Margaric acid
ME658960
10465
CA1365
-
-
TRIDECANOIC ACID
Tridecylic acid
ME659123
12530
CA1367
-
-
1,2-DIDECANOYL-SN-GLYCERO-3-PHOSPHOCHOLINE
PC 10:0/10:0
ME658756
-
CA1375
-
-
NORMETANEPHRINE
Normetanephrine
ME659038
1237
CA1379
-
-
HEPTANOIC ACID
Heptylic acid
ME658962
8094
CA1393
-
-
LAUROYLCARNITINE
CAR 12:0
ME658989
10427569
CA1406
-
-
DEHYDROISOANDROSTERONE 3-SULFATE
Dehydroepiandrosterone sulfate
ME658908
12594
CA1407
-
-
4-HYDROXY-3-METHOXYPHENYLGLYCOL
Vanylglycol
ME658810
10805
CA1410
-
-
BOC-A-(1-NAPHTHYLMETHYL)-DL-PRO-OH
-
ME658865
-
CA1419
-
-
BOC-SER-OH
-
ME658876
-
CA1423
-
-
BOC-THR-OH
-
ME658877
-
CA1425
-
-
4-HYDROXY-L-PHENYLGLYCINE
4-Hydroxyphenylglycine
ME658811
36143
CA1445
-
-
N-ACETYL-DL-GLUTAMIC ACID
N-Acetylglutamic acid
ME659013
70914
CA1454
-
-
P-BROMO-DL-PHENYLALANINE
P-Bromo-DL-phenylalanine
ME659053
85681
CA1463
-
-
OPHTHALMIC ACID
Ophthalmic acid
ME659047
7018721
CA1475
-
-
O-PHOSPHONOHEXOPYRANOSE
-
ME659041
-
CA1494
-
-
DIHEXOSE
-
ME658915
-
CA1495
-
-
PHOSPHOGLYCERIC ACID
Phosphoglyceric acid
ME659070
724
CA1497
-
-
AMINOBUTANOIC ACID
Aminobutyric acid
ME658843
119
CA1498
-
-
AMINOPENTANOIC ACID
Aminopentanoic acid
ME658846
-
CA1501
-
-
AMINOHEXANOIC ACID
Aminocaproic acid
ME658844
564
CA1502
-
-
HEXURONIC ACID
Hexuronic acid
ME658967
152867
CA1503
-
-
DIMETHYLXANTHINE
-
ME658921
-
CA1507
-
-
DIMETHYLXANTHINE (*)
-
ME658922
-
CA1507
-
-
AMINOHYDROXYBUTANOIC ACID
-
ME658845
-
CA1508
-
-
PYRIDINE CARBOXYLIC ACID
-
ME659081
-
CA1509
-
-
HEXITOL
Sorbitol
ME658966
453
CA1510
-
-
PENTITOL
Arabitol
ME659061
827
CA1511
-
-
GLYCEROL PHOSPHATE
sn-Glycero-3-phosphate
ME658948
439162
CA1512
-
-
HYDROXYBENZOIC ACID
Hydroxybenzoic acid
ME658971
135
CA1517
-
-
N,N`-DIACETYL-CYSTINE
-
ME659010
-
CA1519
-
-
CHOLESTEROL SULFATE
Cholesterol sulfate
ME658885
65076
CA1523
-
-
N-ACETYL-L-CYSTEINE
N-Acetylcysteine
ME659016
12035
CE1310
-
-
OLEOYLGLYCEROPHOSPHOETHANOLAMINE (*)
LPE 18:1
ME659046
-
K21510
-
-
HYDROXYDECANOATE (*)
Hydroxydecanoic acid
ME658972
-
K21895
-
-
ARACHIDONOYLGLYCEROPHOSPHOETHANOLAMINE (*)
-
ME658853
-
K22267
-
-
PALMITOYLGLYCEROPHOSPHOETHANOLAMINE / PALMITOYLPLA...
-
ME659057
-
K22338
-
-
HEPTADECENOATE (*)
Heptadecenoic acid
ME658961
-
K22942
-
-
DODECENOATE (*)
Dodecenoic acid
ME658927
-
K23296
-
-
HYDROXYISOVALERATE (*)
-
ME658973
-
K23382
-
-
P-ACETAMIDOPHENYLGLUCURONIDE (*)
p-Acetamidophenylglucuronide
ME659052
4022661
K23498
-
-
ARACHIDONOYLGLYCEROPHOSPHOINOSITOL (*)
-
ME658854
-
K24042
-
-
STEAROYLGLYCEROPHOSPHOETHANOLAMINE (*)
LPE 18:0
ME659106
-
K24332
-
-
SALICYLURIC GLUCURONIDE (*)
Salicyluric glucuronide
ME659098
-
K24500
-
-
HYDROXYACETAMINOPHEN SULFATE (*)
Hydroxyacetaminophen sulfate
ME658970
-
K24525
-
-
CINNAMOYLGLYCINE (*)
Cinnamoylglycine
ME658888
709625
K24551
-
-
LINOLEOYLGLYCEROPHOSPHOETHANOLAMINE (*)
LPE 18:2
ME658993
-
K24671
-
-
PALMITOYLGLYCEROPHOSPHOINOSITOL (*)
LPI 16:0
ME659058
-
K25208
-
-
DESMETHYLNAPROXEN SULFATE (*)
-
ME658912
-
K25428
-
-
3-CARBOXY-4-METHYL-5-PROPYL-2-FURANPROPANOATE
3-Carboxy-4-methyl-5-propyl-2-furanpropanoic acid
ME658785
123979
K25632
-
-
INDOLEPROPIONATE (*)
3-Indolepropionic acid
ME658980
3744
K25954
-
-
OCTADECANEDIOATE (*)
Octadecanedioic acid
ME659043
70095
K26463
-
-
BOC-ALA
-
ME658866
-
-
-
-
BOC-ASN
-
ME658868
-
-
-
-
UCSD Metabolomics Workbench, a resource sponsored by the Common Fund of the National Institutes of Health
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