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


and

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




INPUT WORD = C00012532 , 50% or more
[ Metabolite Name : (1R,2R)-1,2-Dimethyl-2-(4-methyl-1,4-cyclohexadien-1-yl)cyclopentanemethanol acetate , Dihydrotochuinyl acetate ]
Number of matched data : 50

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012531 (-)-Tochuinyl acetate
Tochuinol acetate
Tochuinyl acetate		 100.00
C00049252 Parahigginol C
(-)-Parahigginol C		 92.50
C00012547 (S)-4-Methyl-6-(1,2,2-trimethylcyclopentyl)-1,3-benzenediol 1-acetate
HM2		 90.24
C00012536 [1S-(1alpha,2beta,5alpha)]-4-Bromo-5-(1,2-dimethylbicyclo[3.1.0]hex-2-yl)-2-methylphenol acetate
Cyclolaurenol acetate		 88.10
C00041583 Haterumadysin B
(-)-Haterumadysin B		 88.10
C00049251 Parahigginol B
(-)-Parahigginol B		 88.10
C00012548 (S)-4-Methyl-2-(1,2,2-trimethylcyclopentyl)-1,3-benzenediol 1-acetate
HM3		 87.80
C00012533 Cuparenic acid 87.18
C00020080 3-Methoxy-14-calamenoic acid 87.18
C00020175 3-Methoxy-8-calamenenol
(1S,3R,4R)-7-Methoxycalamenen-3-ol		 87.18
C00020179 3-Methoxy-8-calamenenone
(1S,4R)-7-Methoxycalamenen-3-one		 87.18
C00021655 7-Hydroxy-10-oxodehydrodihydrobotrydial 87.18
C00021656 7,10-Dihydroxydehydrodihydrobotrydial 87.18
C00047776 Candenatenin D
(-)-Candenatenin D		 87.18
C00020176 8-Acetoxy-3-methoxycalamenene
(1S,3R,4R)-7-Methoxycalamenen-3-yl acetate		 86.05
C00012507 (R)-4-Bromo-2-methyl-5-(1,2,2-trimethyl-3-cyclopenten-1-yl)phenol acetate
Cupalaurenol acetate		 85.37
C00033749 Cytosporone C 85.37
C00002764 [6]-Paradol 85.00
C00002774 [6]-Shogaol 85.00
C00030106 delta1,3-Hydroxybakuchiol 85.00
C00045889 Enokipodin C
(-)-Enokipodin C		 85.00
C00011900 (+/-)-ar-Todomatuic acid
ar-Todomatuic acid
(R)-4-(1,5-Dimethyl-3-oxohexyl)benzoic acid		 84.62
C00012512 2,3-Dihydroxycuparene
(S)-3-Methyl-6-(1,2,2-trimethylcyclopentyl)-1,2-benzenediol		 84.62
C00012544 (S)-4-Hydroxy-3-(1,2,2-trimethylcyclopentyl)benzaldehyde
(-)-alpha-Formylherbertenol		 84.62
C00012546 Herbertenolide
(3aS-trans)-2,3,3a,9b-Tetrahydro-3a,8,9b-trimethylcyclopenta[c][1]benzopyran-4(1H)-one		 84.62
C00012553 Aplysinol
[3S-(3alpha,3abeta,8bbeta)]-7-Bromo-1,2,3,8b-tetrahydro-3,6,8b-trimethyl-3aH-cyclopenta[b]benzofuran-3a-methanol		 84.62
C00012554 [3S-(3alpha,3abeta,8bbeta)]-7-Bromo-1,2,3,8b-tetrahydro-3,6,8b-trimethyl-3aH-cyclopenta[b]benzofuran-3a-carboxaldehyde
Aplysinal		 84.62
C00012559 (2alpha,3alpha,4beta,5alpha)-(+)-7-Bromo-2,3,4,5-tetrahydro-4,5,8-trimethyl-2,5-Methano-1-benzoxepin-3-carboxaldehyde
Caraibical		 84.62
C00012561 (2alpha,5beta,10S*)-(-)-7-bromo-4,5-dihydro-5,8,10-trimethyl-2,5-methano-1-benzoxepin-2(3H)-methanol
Filiforminol		 84.62
C00012565 [2S-(2alpha,5alpha,10S*)]-2-(Dibromomethyl)-2,3,4,5-tetrahydro-5,8,10-trimethyl-2,5-methano-1-benzoxepin 84.62
C00012751 Coralloidin A
[2R-(2alpha,5beta,8aalpha)]-1,2,3,5,6,7,8,8a-Octahydro-5,8a-dimethyl-3-(1-methylethylidene)-2-naphthalenol acetate		 84.62
C00012752 (-)-Coralloidin C
Coralloidin C
(1R-trans)-1,3,4,5,6,7-Hexahydro-1-methyl-7-(1-methylethylidene)-4a(2H)-naphthalenemethanol acetate		 84.62
C00015791 Isocannabispiran 84.62
C00016866 3097B2 84.62
C00016867 3097C2 84.62
C00020079 3-Hydroxy-14-calamenoic acid 84.62
C00022587 Isovalerylferulate 84.62
C00022588 Isovaleryl-cis-ferulate 84.62
C00030422 Goniothalesdiol A 84.62
C00036367 1,15-Dihydroxyherbertene 84.62
C00045507 10-Oxodehydrodihydrobotrydial
(+)-10-Oxodehydrodihydrobotrydial		 84.62
C00045887 Enokipodin A
(+)-Enokipodin A		 84.62
C00045888 Enokipodin B
(-)-Enokipodin B		 84.62
C00045890 Enokipodin D
(+)-Enokipodin D		 84.62
C00046557 12-Hydroxydehydrobotrydienol
(+)-12-Hydroxydehydrobotrydienol		 84.62
C00047667 4-Acetoxy-5-brasilene 84.62
C00018777 Dienomycin B 83.72
C00003474 Podocarpic acid 83.33
C00021658 7-Hydroxy-10-ethoxydehydrodihydrobotrydial 83.33
C00035987 Abietatriene
bietatriene
Abieta-8,11,13-triene
Dehydroabietane		 83.33
Page Top