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


and

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





INPUT WORD = C00045576 , 50% or more
[ Metabolite Name : 5-Hydroxycoumarin ]
Number of matched data : 94

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00002503 Umbelliferone
7-Hydroxycoumarin
Umbelliferon
96.00
C00049093 5-Methylcoumarin 96.00
C00029555 5,7-Dihydroxycoumarin 92.59
C00002460 Coumarin 92.00
C00019143 3-Hydroxycoumarin
3-Coumarinol
92.00
C00026388 4-Hydroxyquinolin-2(1H)-one
2,4-Dihydroxyquinoline
DHQ
92.00
C00044485 7-Hydroxychromone 92.00
C00000553 5-Hydroxy-2-methylchromone 88.89
C00002422 5,7-Dihydroxychromone
5,7-Dihydroxy-4-chromone
88.89
C00002462 Daphnetin 88.89
C00002476 Herniarin
7-Methoxycoumarin
88.89
C00044432 2-Hydroxyquinoline
2-Quinolone
88.00
C00002471 Aesculetin
Esculetin
6,7-Dihydroxycoumarin
85.19
C00048593 7-Amino-4-methylcoumarin 85.19
C00038786 cis-2,4-Dihydroxycinnamic acid 84.62
C00000113 Indole-3-carboxylic acid 84.00
C00000152 p-Coumaric acid
p-Coumarate
4-Coumarate
4-coumaric acid
84.00
C00000552 1,8-Dihydroxynaphthalene 84.00
C00002154 Echinopsine 84.00
C00002666 Piperonal 84.00
C00002729 2-Hydroxycinnamic acid
o-Coumaric acid
O-coumaric acid
84.00
C00002756 Melilotic acid 84.00
C00010813 (+)-2,3-Dihydro-6-methyl-3-methylene-2-benzofuranol 84.00
C00029577 6-Methoxy-2H-1-benzopyran
6-Methoxybenzopyran
84.00
C00031015 p-Hydroxyphenyl acetic acid methyl ester 84.00
C00033837 Ethylparaben 84.00
C00036627 Coixol
6-Methoxybenzoxazolin-2(3H)-one
6-Methoxy-benzoxazolin-2(3H)-one
MBOA
84.00
C00038791 cis-p-Coumaric acid
(Z)-p-Coumaric acid
84.00
C00042152 5-Formylbenzofuran 84.00
C00019874 Bakuchicin 83.33
C00002499 Scopoletin 82.76
C00019872 6-Formylumbelliferone 82.76
C00020030 6,7,8-Trihydroxycoumarin 82.76
C00038415 Altechromone A 82.76
C00039097 Ekersenin
Pereflorin
82.76
C00039452 Isoscopoletin 82.76
C00042153 5-Hydroxy-7-methoxychromone 82.76
C00045589 7-Hydroxy-8-methoxycoumarin
Hydrangetin
82.76
C00015976 Cordytropolone 81.48
C00026586 Isalexin 81.48
C00002694 2',6'-Dihydroxy-4'-methoxyacetophenone 80.77
C00018324 Siccayne 80.77
C00030768 Methyl vanillate 80.77
C00032012 Methyl 4-hydroxycinnamate
Methyl 4-hydroxy cinnamate
4-Hydroxycinnamic acid methyl ester
Methyl p-coumarate
Methyl p-hydroxycinnamate
80.77
C00032950 Ethyl 3,4-dihydroxybenzoate
Ethyl protocatechuate
Ethyl 3,4-Dihydroxybenzoate
80.77
C00037676 p-Propoxy benzoic acid 80.77
C00039974 Pestalopyrone 80.77
C00039442 Isofraxetin 80.65
C00000112 Indole-3-carboxaldehyde
Indole-3-carboxyaldehyde
1H-Indole-3-carboxaldehyde
80.00
C00000159 (Z,Z)-Marticaria ester
Matricaria ester
80.00
C00000297 Ficusin
Psoralen
80.00
C00000578 Ayapin 80.00
C00000580 (E)-p-Coumaric acid
trans-4-Hydroxycinnamic acid
trans-p-Coumaric acid
trans-p-Hydroxycinnamic acid
80.00
C00000751 Phenylpyruvic acid 80.00
C00002450 Angelicin 80.00
C00002673 Sesamol 80.00
C00002682 Vanillic acid
3-Methoxy-4-hydroxybenzoic acid
80.00
C00002689 3'-Methoxy-4'-hydroxyacetophenone
Acetovanillone
Apocynin
80.00
C00002704 Paeonol 80.00
C00007511 Caffeoyl aldehyde
Caffeic aldehyde
3,4-Dihydroxycinnamaldehyde
Caffeylaldehyde
80.00
C00010531 Norviburtinal 80.00
C00010727 Viburtinal 80.00
C00010864 Cymorcin 80.00
C00010908 3-Hydroxy-alpha,alpha,4-trimethylbenzyl alcohol 80.00
C00026316 4-Hydroxycinnamate 80.00
C00026478 Quinoline 80.00
C00026981 Isatin 80.00
C00029471 3-(4-Hydroxyphenyl)propionic acid
4-Hydroxydihydrocinnamic acid
Dihydro-p-coumaric acid
80.00
C00029478 3,4'-Dihydroxypropiophenone
4-Hydroxy-(3-hydroxypropionyl)benzene
80.00
C00029502 3-Hydroxy-4-methoxybenzoic acid
Isovanillic acid
80.00
C00030751 Methylparaben
p-Methoxycarbonylphenol
Methyl 4-hydroxybenzoate
80.00
C00030761 Methyl p-anisate
Methyl p-methoxybenzoate
80.00
C00030771 CID is old! 80.00
C00030975 p-Formylbenzoic acid 80.00
C00031034 Piperonylic acid
3,4-Methylenedioxybenzoic acid
80.00
C00032013 Methyl p-formylbenzoate 80.00
C00032695 Acetoisovanillone
Isoacetovanillone
80.00
C00033340 Resacetophenone 80.00
C00033557 CID is old! 80.00
C00034453 Benzyl propionate 80.00
C00034743 Z-Cinnamic acid
cis-Cinnamic acid
80.00
C00035226 4',5'-Dihydropsoralen 80.00
C00035454 1,3,5-Trimethoxybenzene 80.00
C00035487 3,4-Dimethoxybenzyl alcohol 80.00
C00035885 Tropic acid 80.00
C00040996 3,4-Dihydroxybenzeneacetic acid
Homoprotocatechuic acid
80.00
C00041284 5-Hydroxyindole-3-carbaldehyde 80.00
C00042023 1,2,3-Trimethoxybenzene 80.00
C00044524 Annularin E 80.00
C00044988 p-(Acetylamino)benzyl alcohol 80.00
C00045587 7-Hydroxy-1(3H)-isobenzofuranone 80.00
C00046823 Methyl-beta-orcinol carboxylate 80.00
C00046935 Streptazone B1 80.00
C00046936 Streptazone B2 80.00
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