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


and

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




INPUT WORD = C00040067 , 50% or more
[ Metabolite Name : Premnaspirodiene ]
Number of matched data : 73

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00007637 Vetispiradiene 100.00
C00017518 1,2,3,4,4a,5,6,7-Octahydro-4a,5-Dimethyl-2-(1-methylethenyl)naphthalene 96.77
C00033916 Hinesol
(-)-Hinesol		 93.94
C00048308 Agarospirol
(-)-Agarospirol		 93.94
C00016974 (1S-cis)-1,2,3,5,6,7,8,8a-Octahydro-1,8a-dimethyl-7-(1-methylethylidene)naphthalene 93.55
C00016975 Eremophilene 93.55
C00016993 (-)-Nootkatene
Nootkatene		 93.55
C00034741 Valencene 93.55
C00037115 Eremophila-1(10),8,11-triene 93.55
C00016998 (+)-Valencenol
Valencenol		 90.91
C00011585 Striatol 90.63
C00017467 1(10),8-Aristoladiene
Aristola-1(10),8-diene
Aristolediene
1,2,9,10-Tetradehydroaristolane		 90.63
C00021220 Viridiflorene
Ledene
Ledene Oxide		 90.63
C00029818 beta-Maaliene 90.63
C00029881 Calarene
(+)-1(10)-Aristolene		 90.63
C00003186 beta-Eudesmene
beta-Selinene		 90.32
C00007453 beta-Elemene
Cyclohexane		 90.32
C00011583 Striatene 90.32
C00011720 (-)-Germacrene D
Germacrene D
(+)-germacrene D		 90.32
C00011971 Bicycloelemene
(-)-Bicycloelemene
3-Ethenyl-3,7,7-trimethyl-2-(1-methylethenyl)bicyclo[4.1.0]heptane		 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
C00016992 beta-Vetivenene 90.32
C00020379 alpha-Bulnesene
delta-Guaiene		 90.32
C00030345 gamma-Cadinene 90.32
C00034408 CID is old! 90.32
C00035434 (-)-cis-beta-Elemene 90.32
C00035828 gamma-Amorphene
(+)-gamma-Amorphene		 90.32
C00036271 (-)-beta-Elemene 90.32
C00036278 (-)-gamma-Cadinene 90.32
C00040349 Spirolepechinene
(-)-Spirolepechinene		 90.32
C00049948 3-Hydroxysolavetivone
(+)-3-Hydroxysolavetivone		 88.57
C00017469 1(10)-Aristolen-12-al
[1S-(1alpha,1aalpha,7alpha,7aalpha,7balpha)]-1a,2,3,5,6,7,7a,7b-octahydro-1,7,7a-trimethyl-1H-cyclopropa[a]naphthalene-1-carboxaldehyde		 88.24
C00012437 (-)-Lepidozenol
Lepidozenol		 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
C00012806 Acolamone
[2S-(2alpha,4aalpha,8abeta)]-Octahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1(2H)-naphthalenone		 87.88
C00016985 (+)-Isovalencenol
Isovalencenol		 87.88
C00016987 (+)-Nootkatone
Nootkanone
Nootkatone
4betaH,5alpha-Eremophila-1(10),11-dien-2-one		 87.88
C00016988 Isofukinone 87.88
C00016989 Eremophilone
Eremophila-1(10),11-dien-9-one		 87.88
C00016999 (+)-Valerianol
Kusenol
Kusunol
Valerianol		 87.88
C00017000 Eremoligenol
Eremophil-1(10)-en-11-ol		 87.88
C00020144 Isoepicubenol 87.88
C00038051 (-)-Chiloscyphone 87.88
C00049098 7-epi-beta-Eudesmol 87.88
C00011711 [1R-(1R*,2E,4R*,7E)]-1,7-Dimethyl-4-(1-methylethyl)-2,7-cyclodecadien-1-ol 87.50
C00011713 (-)-1(10)E,5E-Germacradien-4-ol
[1S-(1R*,2E,4R*,7E)]-1,7-Dimethyl-4-(1-methylethyl)-2,7-cyclodecadien-1-ol
(-)-1(10),5-Germacradien-4-ol		 87.50
C00011714 Preisocalamendiol
Preisocalamenediol		 87.50
C00011715 Periplanone C
Periplanone D1		 87.50
C00011716 (-)-Periplanone D
Periplanone D
Periplanone D2		 87.50
C00011726 4(15),5E,10(14)-Germacratrien-1-one 87.50
C00012003 Shyobunon
Shyobunone		 87.50
C00012004 Epishyobunone 87.50
C00012005 (-)-Elemol
Elemol
alpha-Elemol		 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
C00021225 [1aR-(1aalpha,4alpha,7alpha,7abeta,7balpha)]-1a,2,3,4,6,7,7a,7b-Octahydro-1,1,4,7-tetramethyl-1H-cycloprop[e]azulene 87.50
C00021720 beta-Cedrene
(+)-beta-Cedrene		 87.50
C00021721 (+)-2,5-Diepi-beta-cedrene 87.50
C00021758 Tricyclovetivene
Zizaene
Khusimene		 87.50
C00021860 (-)-Sativene
Sativene		 87.50
C00021886 beta-Barbatene
Gymnomitrene
beta-Gymnomitrene
beta-Pompene		 87.50
C00021986 beta-Neoclovene 87.50
C00024004 (-)-Longifolene 87.50
C00030187 (-)-Ledene
ent-Ledene
(-)-Leden		 87.50
C00031626 beta-Elemol 87.50
C00033660 beta-Ylangene 87.50
C00035811 beta-Funebrene
(-)-beta-Funebrene		 87.50
C00036763 Aromadendra-1,9-diene 87.50
C00044033 (+)-beta-Copaene 87.50
C00048329 beta-Copaene 87.50
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