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


and

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





INPUT WORD = C00036581 , 50% or more
[ Metabolite Name : 4-Isopropylbenzoic acid , cumic acid ]
Number of matched data : 67

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00010843 Macropone 95.83
C00003039 Cuminal
Cumin aldehyde
4-Isopropyl benzaldehyde
Cuminaldehyde
Cuminyl aldehyde
Cumaldehyde
91.67
C00010858 4-Isopropenylbenzaldehyde 91.67
C00032013 Methyl p-formylbenzoate 91.67
C00032864 Cumin alcohol
p-Cymen-7-ol
Cuminyl alcohol
p-Isopropylbenzyl alcohol
91.67
C00036387 1,4-p-Menthadien-7-ol 91.67
C00037676 p-Propoxy benzoic acid 88.46
C00000619 Eugenol 87.50
C00000620 Isoeugenol 87.50
C00003062 beta-Thujaplicin 87.50
C00003063 gamma-Thujaplicin 87.50
C00010866 3-Methoxy-p-cymene
Thymyl methyl ether
1-Isopropyl-2-methoxy-4-methylbenzene
2-Isopropyl-5-methylanisole
Thymol methyl ether
Methyl thymyl ether
87.50
C00011003 4,4-Dimethyl-1,6-cycloheptadienecarboxylic acid 87.50
C00011009 beta-Dolabrin 87.50
C00029502 3-Hydroxy-4-methoxybenzoic acid
Isovanillic acid
87.50
C00029536 4-Methoxybenzoic acid
p-Anisic acid
87.50
C00030761 Methyl p-anisate
Methyl p-methoxybenzoate
87.50
C00033837 Ethylparaben 87.50
C00035015 2-Phenylethyl acetate 87.50
C00035095 E-Isoeugenol
trans-Isoeugenol
87.50
C00037604 p-Cymen-9-ol 87.50
C00041076 p-Anisate 87.50
C00044988 p-(Acetylamino)benzyl alcohol 87.50
C00044987 p-(Acetylamino)benzoic acid 84.62
C00046194 N-Butylbenzamide 84.62
C00048195 Terricollene C 84.62
C00011046 Chaminic acid
(1S,6R)-(+)-7,7-dimethyl-3-Carene-3-carboxylic acid
84.00
C00026243 Glycorine
1-Methyl-4-quinazolone
84.00
C00031034 Piperonylic acid
3,4-Methylenedioxybenzoic acid
84.00
C00000155 m-Thymol
Thymol
83.33
C00000170 Cinnamate
trans-Cinnamic acid
trans-Cinnamate
83.33
C00001386 L-Phenylalanine
L-Phe
83.33
C00002658 2-Hydroxymethylbenzoic acid 83.33
C00002689 Acetovanillone
Apocynin
83.33
C00002704 Paeonol 83.33
C00002713 Anethole
(E)-Anethole
83.33
C00002740 Estragol
Methyl chavicol
Estragole
Esdragol
83.33
C00003040 p-Cymene
4-Cymene
83.33
C00003060 alpha-Terpinene 83.33
C00003061 gamma-Terpinene
1-Methyl-4-(1-methylethyl)-1,4-cyclohexadiene
83.33
C00010359 5-Ethylidene-5,6-dihydro-3,6,6-trimethyl-2-pyranone 83.33
C00010864 Cymorcin 83.33
C00010870 Perillic acid
(+-)-Perrillic acid
83.33
C00010905 alpha,4-Dimethylstyrene
p-Cymenene
p-Isopropenyltoluene
p-Isopropenyl toluene
Dehydro-p-cymene
83.33
C00010907 p-Mentha-1,3,8-triene
1,3,8-p-Menthatriene
83.33
C00010980 (-)-5,5-Dimethyl-4-methylene-2-cyclohexene-1-carboxylic acid 83.33
C00010999 2,4,4-Trimethyl-1-cyclohexene-1-carboxylic acid
beta-Cyclolavandulic acid
83.33
C00011004 4,4-Dimethyl-2,5-cycloheptadienecarboxylic acid 83.33
C00011005 4,4-Dimethyl-2,6-cycloheptadienecarboxylic acid 83.33
C00011006 5,5-Dimethyl-1,3-cyclopeptadienecarboxylic acid 83.33
C00011007 5,5-Dimethyl-1,3,6-cycloheptatriene-1-carboxylic acid 83.33
C00011012 4-Isopropyl-2,4,6-cycloheptatrien-1-one
Nezukone
83.33
C00029334 trans-Anethol
(E)-Anethol
trans-1-(4-Methoxyphenyl)-1-propene
trans-Anethole
83.33
C00030751 Methylparaben
p-Methoxycarbonylphenol
Methyl 4-hydroxybenzoate
83.33
C00030771 CID is old! 83.33
C00030933 p-Cymen-8-ol 83.33
C00030975 p-Formylbenzoic acid 83.33
C00034769 4-Hydroxy-2-methoxybenzoic acid 83.33
C00035454 1,3,5-Trimethoxybenzene 83.33
C00035903 cis-Isoeugenol
Z-Isoeugenol
83.33
C00037504 (methylthio-methyl)sulfone 83.33
C00040742 (-)-Rhododendrol 83.33
C00041092 4-(4-Hydroxyphenyl)-2-butanone
Rheosmin
83.33
C00042066 2,4-Dichlorobenzoic acid 83.33
C00042126 3-Hydroxy-4-methoxyphenethylamine
p-Methoxydopamine
83.33
C00042132 3-Methoxytyramine 83.33
C00042859 p-Methoxyamphetamine 83.33
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