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


and

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




INPUT WORD = C00012708 , 50% or more
[ Metabolite Name : Eudesma-3,7(11)-diene , Selina-3,7(11)-diene , 1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-2-(1-methylethenyl)-Naphthalene ]
Number of matched data : 66

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00011583 Striatene 93.55
C00029678 alpha-Maaliene 90.63
C00012709 (-)-alpha-Helmiscapene
alpha-Helmiscapene
[2S-(2a,4ab,8ab)]-1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-2-(1-methylethenyl)naphthalene		 90.32
C00012710 5beta,10alpha-Eudesma-3,11-diene 90.32
C00012711 [2R-(2alpha,4aalpha,8aalpha)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-2-(1-methylethenyl)naphthalene 90.32
C00021903 trans-alpha-Bergamotene
(Z)-alpha-exo-bergamotol
(-)-exo-alpha-Bergamotene
(E)-alpha-Bergamotene
alpha-trans-Bergamotene
alpha-(E)-Bergamotene		 90.32
C00021952 Isowiddrene
alpha-Pseudowiddrene		 90.32
C00029672 (-)-alpha-Selinene
alpha-Selinene		 90.32
C00029970 cis-alpha-Bergamotene
alpha-cis-bergamotene		 90.32
C00030189 epi-alpha-Selinene 90.32
C00036276 (-)-Eudesma-2,4(15)-11-triene 90.32
C00036298 (+)-alpha-Selinene 90.32
C00048297 7-epi-alpha-Selinene 90.32
C00048311 alpha-Bergamotene 90.32
C00049260 Penidienone
(-)-Penidienone		 90.32
C00012738 (2R-cis)-1,2,3,4,6,7,8,8a-Octahydro-5,8a-dimethyl-3-(1-methylethylidene)-2-naphthalenol 87.88
C00017003 Fukinone
(+)-Eremophil-7(11)-en-8-one		 87.88
C00036277 (-)-Eudesma-3,11-dien-5-ol 87.88
C00003118 alpha-Copaene
Copaene
(-)-alpha-Copaene		 87.50
C00003203 alpha-Ylangene 87.50
C00011585 Striatol 87.50
C00021205 beta-Spathulene 87.50
C00021860 (-)-Sativene
Sativene		 87.50
C00021865 Copadiene 87.50
C00037613 Penienone
(-)-Penienone		 87.50
C00003181 beta-Santalene 87.10
C00007635 CID is old! 87.10
C00011971 Bicycloelemene
(-)-Bicycloelemene
3-Ethenyl-3,7,7-trimethyl-2-(1-methylethenyl)bicyclo[4.1.0]heptane		 87.10
C00012012 (-)-gamma-Elemene
gamma-Elemene		 87.10
C00012714 Selina-4(14),7(11)-diene
Eudesma-4(14),7(11)-diene
(4aR-trans)-Decahydro-4a-methyl-1-methylene-7-(1-methylethylidene)naphthalene		 87.10
C00016569 (S)-12-Methyl-1-tetradecanamine
Medelamine B
NK 148198B		 87.10
C00016974 (1S-cis)-1,2,3,5,6,7,8,8a-Octahydro-1,8a-dimethyl-7-(1-methylethylidene)naphthalene 87.10
C00016975 Eremophilene 87.10
C00016992 beta-Vetivenene 87.10
C00020380 Sclerosporene 87.10
C00021764 Epizizanal 87.10
C00029559 (+)-5-epi-Aristolochene
5-epi-Aristolochene
(+)-Epiaristolochene		 87.10
C00034741 Valencene 87.10
C00035434 (-)-cis-beta-Elemene 87.10
C00035435 (-)-Perfora-1,7-diene 87.10
C00035606 epi-beta-Santalene 87.10
C00036271 (-)-beta-Elemene 87.10
C00037851 CID is old! 87.10
C00038319 7-epi-Sesquithujene 87.10
C00012719 [2R-(2alpha,4aalpha,5beta,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-5-hydroxy-4a,8-dimethyl-b-methylene-2-naphthaleneethanol
Cnicothamnol		 85.71
C00012720 Cnicothamnal
[2R-(2alpha,4aalpha,5beta,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-5-hydroxy-4a,8-dimethyl-a-methylene-2-naphthaleneacetaldehyde		 85.71
C00041900 Suberosenone
(+)-Suberosenone		 85.29
C00003198 alpha-Vetivone 84.85
C00012734 alpha-Dictyopterol
Eudesma-3,11-dien-1beta-ol
[1S-(1alpha,4abeta,6alpha,8aalpha)]-1,2,4a,5,6,7,8,8a-Octahydro-4,8a-dimethyl-6-(1-methylethenyl)-1-naphthalenol		 84.85
C00012736 Ent-8beta-hydroxyeudesma-3,11-diene
[2S-(2alpha,3alpha,4abeta,8aalpha)]-1,2,3,4,4a,7,8,8a-Octahydro-5,8a,dimethyl-3-(1-methylethenyl)-2-naphthalenol		 84.85
C00012737 alpha-Costol
(-)-alpha-Costol
[2R-(2alpha,4aalpha,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-beta-methylene-2-naphthaleneethanol		 84.85
C00012755 (4aR-cis)-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethylidene)-2(1H)-naphthalenone 84.85
C00012756 [4aR-(4aalpha,6beta,8aalpha)]-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone 84.85
C00012757 [4aS-(4aalpha,6alpha,8abeta)]-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone 84.85
C00012758 [4aS-(4aalpha,6alpha,8aalpha)]-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone 84.85
C00012801 alpha-Verbesinol
[1R-(1alph,2alpha,4aalpha,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-2-(1-methylethyl)-1-naphthalenol		 84.85
C00012802 Isoacolamone
[2S-(2alpha,4aalpha,8abeta)]-3,4,4a,5,6,8a-Hexahydro-4a,8-dimethyl-2-(1-methylethyl)-1(2H)-naphthalenone		 84.85
C00012803 7-epi-alpha-Eudesmol
[2S-(2alpha,4abeta,8aalpha)]-1,2,3,4,4a,5,6,8a-Octahydro-alpha,alpha,4a,8-tetramethyl-2-naphthalenemethanol		 84.85
C00016990 Eremophila-1,11-dien-9-one 84.85
C00017005 Eremofukinone 84.85
C00020407 Karatavin 84.85
C00021845 Campherenone 84.85
C00021859 (+)-Cyclosativene
Cyclosativene		 84.85
C00021864 Sinularene 84.85
C00029348 (Z)-alpha-trans-Bergamotol 84.85
C00038047 (-)-7-epi-Isojunenol 84.85
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