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


and

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





INPUT WORD = C00011012 , 50% or more
[ Metabolite Name : 4-Isopropyl-2,4,6-cycloheptatrien-1-one , Nezukone ]
Number of matched data : 55

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00003062 beta-Thujaplicin 91.67
C00003063 gamma-Thujaplicin 91.67
C00011009 beta-Dolabrin 91.67
C00003039 Cuminal
Cumin aldehyde
4-Isopropyl benzaldehyde
Cuminaldehyde
Cuminyl aldehyde
Cumaldehyde
90.91
C00010858 4-Isopropenylbenzaldehyde 90.91
C00029535 4-Isopropyl-2-methylphenol
Isocarvacrol
90.91
C00032864 Cumin alcohol
p-Cymen-7-ol
Cuminyl alcohol
p-Isopropylbenzyl alcohol
90.91
C00036387 1,4-p-Menthadien-7-ol 90.91
C00011011 2-Hydroxy-3-isopropyl-2,4,6-cycloheptatrien-1-one
alpha-Thujaplicin
87.50
C00000155 m-Thymol
Thymol
86.36
C00000156 Carvacrol 86.36
C00010341 3-(4-Methyl-1,4-pentadienyl)furan
Lepalene
86.36
C00010968 2-Isopropyl-p-cresol
4-Methyl-2-isopropylphenol
86.36
C00030933 p-Cymen-8-ol 86.36
C00030975 p-Formylbenzoic acid 86.36
C00037604 p-Cymen-9-ol 86.36
C00042852 p-Hydroxyamphetamine 86.36
C00011000 2,7-Dihydroxy-3-isopropyl-2,4,6-cycloheptatrienone 84.62
C00010843 Macropone 83.33
C00036581 4-Isopropylbenzoic acid
cumic acid
83.33
C00000112 Indole-3-carboxaldehyde
Indole-3-carboxyaldehyde
1H-Indole-3-carboxaldehyde
82.61
C00002698 p-Hydroxyacetophenone
Piceol
4'-Hydroxyacetophenone
81.82
C00003040 p-Cymene
4-Cymene
81.82
C00003060 alpha-Terpinene 81.82
C00003061 gamma-Terpinene
1-Methyl-4-(1-methylethyl)-1,4-cyclohexadiene
81.82
C00010905 4-Isopropenyl-1-methylbenzene
alpha,4-Dimethylstyrene
p-Cymenene
p-Isopropenyltoluene
p-Isopropenyl toluene
Dehydro-p-cymene
81.82
C00010906 Dehydrocarvacrol
5-Isopropenyl-2-methylphenol
81.82
C00010907 p-Mentha-1,3,8-triene
1,3,8-p-Menthatriene
81.82
C00010967 beta-Cymene
m-Cymene
1-Methyl-3-(1-methylethyl)benzene
1-Isopropyl-3-methylbenzene
81.82
C00010974 alpha-Cymene
o-Cymol
0-Isopropyltoluene
1-Isopropyl-2-methylbenzene
o-Cymene
2-Isopropyltoluene
81.82
C00027432 N-Methyltyramine 81.82
C00029536 4-Methoxybenzoic acid
p-Anisic acid
Anisic acid
p-Methoxybenzoic acid
81.82
C00030751 Methylparaben
p-Methoxycarbonylphenol
Methyl 4-hydroxybenzoate
81.82
C00031014 p-Coumaraldehyde
4-Hydroxycinnamaldehyde
p-Hydroxycinnamaldehyde
p-Coumaroyl aldehyde
81.82
C00033340 Resacetophenone 81.82
C00034140 p-Hydroxymandelonitrile 81.82
C00040821 3'-Hydroxyacetophenone 81.82
C00041076 p-Anisate 81.82
C00044457 4-Allyl-pyrocatechol
4-Allylcatechol
81.82
C00044491 Acetaminophen 81.82
C00044952 N-Butylbenzenamine 81.82
C00047668 CID is old! 81.82
C00011001 Pygmaein 80.77
C00018324 Siccayne 80.77
C00002704 Paeonol 79.17
C00007511 Caffeoyl aldehyde
Caffeic aldehyde
3,4-Dihydroxycinnamaldehyde
Caffeylaldehyde
79.17
C00010862 2,5-Dihydroxy-p-cymene
Hydrothymoquinone
Thymohydroquinone
79.17
C00010866 3-Methoxy-p-cymene
Thymyl methyl ether
1-Isopropyl-2-methoxy-4-methylbenzene
2-Isopropyl-5-methylanisole
Thymol methyl ether
Methyl thymyl ether
79.17
C00029306 (+)-Rhododendrol 79.17
C00030934 p-Cymene-2,3-diol 79.17
C00032695 Acetoisovanillone
Isoacetovanillone
79.17
C00040158 RKB 3564S 79.17
C00040742 (-)-Rhododendrol 79.17
C00041092 4-(4-Hydroxyphenyl)-2-butanone
Rheosmin
79.17
C00048139 Speciosin G 79.17
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