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


and

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





INPUT WORD = C00007453 , 50% or more
[ Metabolite Name : beta-Elemene , Cyclohexane ]
Number of matched data : 56

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00035434 (-)-cis-beta-Elemene 100.00
C00036271 (-)-beta-Elemene 100.00
C00003186 beta-Eudesmene
beta-Selinene
96.77
C00011971 Bicycloelemene
(-)-Bicycloelemene
3-Ethenyl-3,7,7-trimethyl-2-(1-methylethenyl)bicyclo[4.1.0]heptane
96.77
C00012715 (-)-beta-Selinene
(-)-Eudesma-4(14),11-diene
[4aS-(4aalpha,7alpha,8abeta)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene
96.77
C00012716 5beta,10alpha-Eudesma-4(14),11-diene
[4aS-(4aalpha,7beta,8abeta)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene
96.77
C00012717 [4aR-(4aalpha,7alpha,8aalpha)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene 96.77
C00012718 beta-Helmiscapene
[4aR-(4aalpha,7beta,8aalpha)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene
96.77
C00012012 (-)-gamma-Elemene
gamma-Elemene
96.67
C00012003 Shyobunon
Shyobunone
93.75
C00012004 Epishyobunone 93.75
C00012005 (-)-Elemol
Elemol
alpha-Elemol
93.75
C00012013 [1S-(1alpha,2beta,3alpha,5alpha)]-2-Ethenyl-2-methyl-3,5-bis(1-methylethenyl)-cyclohexanol 93.75
C00012018 (-)-beta-Elemenal
(-)-Elema-1,3,11(13)-trien-12-al
93.75
C00016958 gamma-Maaliene 93.75
C00031626 beta-Elemol 93.75
C00033660 beta-Ylangene 93.75
C00044033 (+)-beta-Copaene 93.75
C00048329 beta-Copaene 93.75
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
93.55
C00012710 5beta,10alpha-Eudesma-3,11-diene 93.55
C00012711 [2R-(2alpha,4aalpha,8aalpha)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-2-(1-methylethenyl)naphthalene 93.55
C00012714 Selina-4(14),7(11)-diene
Eudesma-4(14),7(11)-diene
(4aR-trans)-Decahydro-4a-methyl-1-methylene-7-(1-methylethylidene)naphthalene
93.55
C00016965 (+)-beta-Gorgonene
beta-Gorgonen
beta-Gorgonene
93.55
C00020044 (-)-epsilon-Bulgarene 93.55
C00020384 6,9-Guaiadiene 93.55
C00029672 (-)-alpha-Selinene
alpha-Selinene
93.55
C00030189 epi-alpha-Selinene 93.55
C00035724 Panaxene 93.55
C00036276 (-)-Eudesma-2,4(15)-11-triene 93.55
C00036298 (+)-alpha-Selinene 93.55
C00037222 Guaiane 93.55
C00037810 Selina-4(15),5-diene 93.55
C00037811 Selina-5,11-diene 93.55
C00044028 (-)-Eudesma-1,4(15),11-triene 93.55
C00048297 7-epi-alpha-Selinene 93.55
C00011411 2,6,10-Trimethyldodecane
Farnesane
93.33
C00011720 (-)-Germacrene D
Germacrene D
(+)-germacrene D
93.33
C00012011 delta-Elemene 93.33
C00050105 Germacrene E 93.33
C00000164 (+)-beta-Eudesmol
beta-Eudesmol
90.91
C00012746 beta-Dictyopterol
(1alpha,4abeta,6alpha,8aalpha)-(+-)-Decahydro-8a-methyl-4-methylene-6-(1-methylethenyl)-1-naphthalenol
90.91
C00012747 Dictyopterone
Eudesma-4(14),11-dien-1-one
90.91
C00012748 Isocyperol
(-)-Eudesma-4(14),11-dien-3alpha-ol
[2R-(2alpha,4abeta,7beta,8aalpha)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)-2-naphthalenol
90.91
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
90.91
C00012750 (+)-Costal
Costic aldehyde
(+)-beta-Costal
Eudesma-4(14),11(13)-dien-12-al
90.91
C00012804 Eudesm-4(15)-en-5-ol
[3R-(3alpha,4abeta,8aalpha)]-Octahydro-8a-methyl-5-methylene-3-(1-methylethyl)-4a(2H)-naphthalenol
90.91
C00012808 beta-Verbesinol
[1R-(1alpha,2alpha,4aalpha,8abeta)]-Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1-naphthalenol
90.91
C00012812 Isointermedeol 90.91
C00012813 Kongol
Selin-11-en-4alpha-ol
5alpha,7alphaH-Eudesm-11(13)en-4alpha-ol
[1R-(1alpha,4abeta,7beta,8aalpha)]-decahydro-1,4a-dimethyl-7-(1-methylethenyl)-1-naphthalenol
90.91
C00012814 Amiteol
[1R-(1alpha,4abeta,7beta,8abeta)]-Decahydro-1,4a-dimethyl-7-(1-methylethenyl)-1-naphthalenol
90.91
C00012815 neo-Intermedeol
(-)-Neointermedeol
Neointermedeol
[1S-(1alpha,4aalpha,7alpha,8abeta)]-Decahydro-1,4a-dimethyl-7-(1-methylethenyl)-1-naphthalenol
90.91
C00012816 (+)-Intermedeol
5beta,10alpha-Eudesm-11-en-4-ol
Intermedeol
90.91
C00012819 Eudesm-4(14)-en-9-one 90.91
C00036292 (-)-trans-Selina-4(15),11-dien-5-ol 90.91
C00038069 (+)-7-epi-Junenol 90.91
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