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


and

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




INPUT WORD = C00013215 , 50% or more
[ Metabolite Name : Dehydrochamecynenol , (-)-Dehydrochamecynenol , [4aS-(4aalpha,7alpha,8aalpha)]-7-Ethynyl-4a,5,6,7,8,8a-hexahydro-4a-methyl-1-naphthalenemethanol ]
Number of matched data : 52

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00013214 (+)-Chamecynenol
(1alpha,4aalpha,7alpha,8aalpha)-(+)-7-ethynyl-1,2,4a,5,6,7,8,8a-Octahydro-4a-methyl-1-naphthalenemethanol		 96.77
C00013216 Dehydrochamecynenal
(4aalpha,7alpha,8aalpha)-7-Ethynyl-4a,5,6,7,8,8a-Hexahydro-4a-methyl-1-naphthalenecarboxaldehyde		 96.77
C00013217 Chamaecynone
Chamecynone
[1S-(1alpha,4abeta,7beta,8abeta)]-7-Ethynyl-4a,5,6,7,8,8a-hexahydro-1,4a-dimethyl-2(1H)-naphthalenone		 96.77
C00013218 Isochamaecynone
[1R-(1alpha,4aalpha,7alpha,8aalpha)]-7-ethynyl-4a,5,6,7,8,8a-Hexahydro-1,4a-dimethyl-2(1H)-naphthalenone		 96.77
C00044028 (-)-Eudesma-1,4(15),11-triene 93.55
C00013219 7beta-ethynyl-4a,5,6,7,8,8abeta-Hexahydro-1alpha-hydroxy-1,4ab-dimethyl-2(1H)-naphthalenone 90.91
C00003186 beta-Eudesmene
beta-Selinene		 90.32
C00012470 (E,E)-4,4,8-Trimethyl-2,8-cycloundecadien-1-one
Rudbeckianone		 90.32
C00012715 (-)-beta-Selinene
(-)-Eudesma-4(14),11-diene
[4aS-(4aalpha,7alpha,8abeta)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene		 90.32
C00012716 5beta,10alpha-Eudesma-4(14),11-diene
[4aS-(4aalpha,7beta,8abeta)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene		 90.32
C00012717 [4aR-(4aalpha,7alpha,8aalpha)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene 90.32
C00012718 beta-Helmiscapene
[4aR-(4aalpha,7beta,8aalpha)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene		 90.32
C00021867 Copaenol 88.24
C00003139 Guaiol
(-)-Guaiol		 87.88
C00012732 (+)-Occidentalol
Occidentalol
10alpha-Eudesma-1,3-dien-11-ol
[2R-(2alpha,4abeta,8abeta)]-1,2,3,4,4a,8a-hexahydro-alpha,alpha,4a,8-tetramethyl-2-naphthalenemethanol		 87.88
C00012746 beta-Dictyopterol
(1alpha,4abeta,6alpha,8aalpha)-(+-)-Decahydro-8a-methyl-4-methylene-6-(1-methylethenyl)-1-naphthalenol		 87.88
C00012747 Dictyopterone
Eudesma-4(14),11-dien-1-one		 87.88
C00012748 Isocyperol
(-)-Eudesma-4(14),11-dien-3alpha-ol
[2R-(2alpha,4abeta,7beta,8aalpha)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)-2-naphthalenol		 87.88
C00012749 (+)-beta-Costol
(+)-Costol
beta-Costol
Sesquibenihiol
Eudesma-4(14),11(13)-dien-12-ol
[2R-(2alpha,4aalpha,8abeta)]-Decahydro-4a-methyl-b,8-bis(methylene)-2-naphthaleneethanol		 87.88
C00012750 (+)-Costal
Costic aldehyde
(+)-beta-Costal
Eudesma-4(14),11(13)-dien-12-al		 87.88
C00012804 Eudesm-4(15)-en-5-ol
[3R-(3alpha,4abeta,8aalpha)]-Octahydro-8a-methyl-5-methylene-3-(1-methylethyl)-4a(2H)-naphthalenol		 87.88
C00012806 Acolamone
[2S-(2alpha,4aalpha,8abeta)]-Octahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1(2H)-naphthalenone		 87.88
C00012819 Eudesm-4(14)-en-9-one 87.88
C00016987 (+)-Nootkatone
Nootkanone
Nootkatone
4betaH,5alpha-Eremophila-1(10),11-dien-2-one		 87.88
C00017515 (-)-Valeranone
(-)-Jatamansone		 87.88
C00036292 (-)-trans-Selina-4(15),11-dien-5-ol 87.88
C00011724 4(15),5E,10(14)-Germacratrien-1alpha-ol 87.50
C00012013 [1S-(1alpha,2beta,3alpha,5alpha)]-2-Ethenyl-2-methyl-3,5-bis(1-methylethenyl)-cyclohexanol 87.50
C00012018 (-)-beta-Elemenal
(-)-Elema-1,3,11(13)-trien-12-al		 87.50
C00012466 (E)-4,4,11-Trimethyl-7-methylene-5-cycloundecen-1-one
1,3(15)-Humuladien-8-one		 87.50
C00016958 gamma-Maaliene 87.50
C00021772 (+)-Prezizaene 87.50
C00021773 (-)-Prezizaene 87.50
C00033660 beta-Ylangene 87.50
C00041047 Maali-1,3-diene
(+)-Maali-1,3-diene		 87.50
C00044033 (+)-beta-Copaene 87.50
C00048329 beta-Copaene 87.50
C00007453 beta-Elemene
Cyclohexane		 87.10
C00007637 Vetispiradiene 87.10
C00011971 Bicycloelemene
(-)-Bicycloelemene
3-Ethenyl-3,7,7-trimethyl-2-(1-methylethenyl)bicyclo[4.1.0]heptane		 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
C00016965 (+)-beta-Gorgonene
beta-Gorgonen
beta-Gorgonene		 87.10
C00020041 beta1-Bulgarene
4,9-Bulgaradiene		 87.10
C00020186 Khusilal 87.10
C00020377 alpha-Guaiene
Guaia-1(5),11-diene		 87.10
C00021589 15-Nor-2-acoren-4-one 87.10
C00034387 3,9-Dimethyl-6-isopropyl-2E,7E,9-decatrienal 87.10
C00035434 (-)-cis-beta-Elemene 87.10
C00036271 (-)-beta-Elemene 87.10
C00037222 Guaiane 87.10
C00037810 Selina-4(15),5-diene 87.10
C00037811 Selina-5,11-diene 87.10
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