"Twins" retrives similar metabolites in chemical structure.
last update : 2020.01.06
KNApSAcK CID : ex.) C00000001


and

Similarity (%) : ex.) 98
% or more





INPUT WORD = C00019143 , 50% or more
[ Metabolite Name : 3-Hydroxycoumarin , 3-Coumarinol ]
Number of matched data : 89

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00002460 Coumarin 92.00
C00002503 Umbelliferone
7-Hydroxycoumarin
Umbelliferon
92.00
C00045576 5-Hydroxycoumarin 92.00
C00002462 Daphnetin 88.89
C00002471 Aesculetin
Esculetin
6,7-Dihydroxycoumarin
88.89
C00000751 Phenylpyruvic acid 88.00
C00026388 4-Hydroxyquinolin-2(1H)-one
2,4-Dihydroxyquinoline
DHQ
88.00
C00026451 Jineol 88.00
C00044432 2-Hydroxyquinoline
2-Quinolone
88.00
C00044485 7-Hydroxychromone 88.00
C00049093 5-Methylcoumarin 88.00
C00002476 Herniarin
7-Methoxycoumarin
85.19
C00026586 Isalexin 85.19
C00029555 5,7-Dihydroxycoumarin 85.19
C00000112 Indole-3-carboxaldehyde
Indole-3-carboxyaldehyde
1H-Indole-3-carboxaldehyde
84.00
C00000150 D-beta-Phenyllactic acid 84.00
C00002154 Echinopsine 84.00
C00002666 Piperonal 84.00
C00002704 Paeonol 84.00
C00023598 4-(Hydroxymethyl)-2-methylindole 84.00
C00029577 6-Methoxy-2H-1-benzopyran
6-Methoxybenzopyran
84.00
C00030761 Methyl p-anisate
Methyl p-methoxybenzoate
84.00
C00035885 Tropic acid 84.00
C00036627 Coixol
6-Methoxybenzoxazolin-2(3H)-one
6-Methoxy-benzoxazolin-2(3H)-one
MBOA
84.00
C00042152 5-Formylbenzofuran 84.00
C00045587 7-Hydroxy-1(3H)-isobenzofuranone 84.00
C00002499 Scopoletin 82.76
C00020030 6,7,8-Trihydroxycoumarin 82.76
C00000100 Indole-3-acetic acid
Indoleacetic acid
IAA
Indole-3-acetate
81.48
C00000553 5-Hydroxy-2-methylchromone 81.48
C00002422 5,7-Dihydroxychromone
5,7-Dihydroxy-4-chromone
81.48
C00026234 2-Hydroxymethyl-4-methylquinazoline 81.48
C00029578 6-Methoxyindoline-2,3-dione 81.48
C00040669 Wutaifuranol 81.48
C00048593 7-Amino-4-methylcoumarin 81.48
C00002694 2',6'-Dihydroxy-4'-methoxyacetophenone 80.77
C00007512 4-Hydroxyphenylpyruvate
p-Hydroxyphenylpyruvic acid
80.77
C00010857 2-(2Hydroxy-4-methylphenyl)-1,3-propanediol
9,10-Dihydroxythymol
80.77
C00010910 Eupatriol 80.77
C00027108 Brassilexin 80.77
C00036489 2-Hydroxy-1,4-benzoxanzine-3(2H)-one
2-Hydroxy-1,4-benzoxazin-3-one
HBOA
80.77
C00000109 Indole-3-acetaldehyde 80.00
C00000113 Indole-3-carboxylic acid 80.00
C00000114 Indole-3-ethanol
Tryptophol
80.00
C00000152 p-Coumaric acid
p-Coumarate
4-Coumarate
4-coumaric acid
80.00
C00000552 1,8-Dihydroxynaphthalene 80.00
C00001354 L-2,5-Dihydrophenylalanine 80.00
C00001386 L-Phenylalanine
L-Phe
Phenylalanine
80.00
C00002450 Angelicin 80.00
C00002646 Syringol 80.00
C00002683 Vanillin 80.00
C00002693 3',4'-Dihydroxyacetophenone 80.00
C00002753 Isosafrole 80.00
C00002771 Safrole 80.00
C00003062 beta-Thujaplicin 80.00
C00007511 Caffeoyl aldehyde
Caffeic aldehyde
3,4-Dihydroxycinnamaldehyde
Caffeylaldehyde
80.00
C00010320 Fusalanipyrone
Fuselanopyrone
80.00
C00011009 beta-Dolabrin 80.00
C00026243 Glycorine
1-Methyl-4-quinazolone
80.00
C00026478 Quinoline 80.00
C00026885 CID is old! 80.00
C00029306 (+)-Rhododendrol 80.00
C00029531 4-Hydroxy-3-methoxybenzaldehyde
Vanillic aldehyde
80.00
C00029536 4-Methoxybenzoic acid
p-Anisic acid
Anisic acid
p-Methoxybenzoic acid
80.00
C00030767 Methyl salicylate 80.00
C00030975 p-Formylbenzoic acid 80.00
C00031015 p-Hydroxyphenyl acetic acid methyl ester 80.00
C00031034 Piperonylic acid
3,4-Methylenedioxybenzoic acid
80.00
C00031089 Methyl protocatechuate
Protocatechuic acid methyl ester
80.00
C00032013 Methyl p-formylbenzoate 80.00
C00032269 CID is old! 80.00
C00032695 Acetoisovanillone
Isoacetovanillone
80.00
C00034453 Benzyl propionate 80.00
C00034743 Z-Cinnamic acid
cis-Cinnamic acid
80.00
C00035015 2-Phenylethyl acetate 80.00
C00035454 1,3,5-Trimethoxybenzene 80.00
C00035487 3,4-Dimethoxybenzyl alcohol 80.00
C00036575 4-Hydroxy-2H-1,4-benzoxazin-3(4H)-one 80.00
C00037426 L-Mandelic acid
L-(+)-Mandelic acid
80.00
C00037926 trans-2-Phenylcyclopropane-1-carboxylic acid 80.00
C00038791 cis-p-Coumaric acid
(Z)-p-Coumaric acid
80.00
C00040158 RKB 3564S 80.00
C00040742 (-)-Rhododendrol 80.00
C00041076 p-Anisate 80.00
C00041092 4-(4-Hydroxyphenyl)-2-butanone
Rheosmin
80.00
C00041284 5-Hydroxyindole-3-carbaldehyde 80.00
C00041598 Indole-3-methanol
Indole-3-carbinol
80.00
C00042023 1,2,3-Trimethoxybenzene 80.00
C00042126 3-Hydroxy-4-methoxyphenethylamine
p-Methoxydopamine
80.00
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