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


and

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




INPUT WORD = C00012014 , 50% or more
[ Metabolite Name : alpha-Elemene , (+)-alpha-Elemene , (-)-alpha-Elemene ]
Number of matched data : 60

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012012 (-)-gamma-Elemene
gamma-Elemene		 93.33
C00003181 beta-Santalene 90.32
C00012714 Selina-4(14),7(11)-diene
Eudesma-4(14),7(11)-diene
(4aR-trans)-Decahydro-4a-methyl-1-methylene-7-(1-methylethylidene)naphthalene		 90.32
C00016976 (-)-Aristolochene
Aristolochen
Aristolochene		 90.32
C00021904 trans-beta-Bergamotene 90.32
C00035606 epi-beta-Santalene 90.32
C00036300 (+)-Aristolochene 90.32
C00037810 Selina-4(15),5-diene 90.32
C00037811 Selina-5,11-diene 90.32
C00007453 beta-Elemene
Cyclohexane		 90.00
C00012011 delta-Elemene 90.00
C00035434 (-)-cis-beta-Elemene 90.00
C00036271 (-)-beta-Elemene 90.00
C00012745 Selina-4(14),7(11)-diene-9-ol
[1S-(1alpha,4abeta,8aalpha)]-Decahydro-8a-methyl-5-methylene-3-(1-methylethylidene)-1-naphthalenol		 87.88
C00021850 alpha-Santalene 87.50
C00003186 beta-Eudesmene
beta-Selinene		 87.10
C00007634 delta-Selinene 87.10
C00007635 CID is old! 87.10
C00011966 Sesquisabinene
Sesquisabinene A		 87.10
C00011971 Bicycloelemene
(-)-Bicycloelemene
3-Ethenyl-3,7,7-trimethyl-2-(1-methylethenyl)bicyclo[4.1.0]heptane		 87.10
C00012712 (R)-1,2,3,4,4a,5,6,7-octahydro-4a,8-dimethyl-2-(1-methylethylidene)naphthalene
(+)-Selin-4,7(11)-diene
(+)-Selina-4,7(11)-diene
4,7(11)-Eudesmadiene		 87.10
C00012715 (-)-beta-Selinene
(-)-Eudesma-4(14),11-diene
[4aS-(4aalpha,7alpha,8abeta)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene		 87.10
C00012716 5beta,10alpha-Eudesma-4(14),11-diene
[4aS-(4aalpha,7beta,8abeta)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene		 87.10
C00012717 [4aR-(4aalpha,7alpha,8aalpha)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene 87.10
C00012718 beta-Helmiscapene
[4aR-(4aalpha,7beta,8aalpha)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)naphthalene		 87.10
C00012775 (4aR-trans)-1,2,3,4,4a,7,8,8a-Octahydro-4a-methyl-1-methylene-7-(1-methylethylidene)naphthalene 87.10
C00016965 (+)-beta-Gorgonene
beta-Gorgonen
beta-Gorgonene		 87.10
C00020383 gamma-gurjunene epoxide
(+)-gamma-Gurjunene
gamma-Gurjunene		 87.10
C00021903 trans-alpha-Bergamotene
(Z)-alpha-exo-bergamotol
(-)-exo-alpha-Bergamotene
(E)-alpha-Bergamotene
alpha-trans-Bergamotene
alpha-(E)-Bergamotene		 87.10
C00029559 (+)-5-epi-Aristolochene
5-epi-Aristolochene
(+)-Epiaristolochene		 87.10
C00029970 cis-alpha-Bergamotene
alpha-cis-bergamotene		 87.10
C00035724 Panaxene 87.10
C00048311 alpha-Bergamotene 87.10
C00007630 beta-Sesquiphellandrene 86.67
C00011722 beta-Germacrene C
(E,E)-1-Methyl-7-methylene-4-(1-methylethyl)-1,3-cyclodecadiene		 86.67
C00012009 (3R-trans)-3-Ethenyl-3-methyl-4-(1-methylethenyl)-6-(1-methylethylidene)-cyclohexene
1,3,7(11),8-Elematetraene		 86.67
C00039822 Nardosinanol A 85.29
C00003183 beta-Santalol
(E)-beta-Santalol		 84.85
C00012755 (4aR-cis)-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethylidene)-2(1H)-naphthalenone 84.85
C00012810 Rosifoliol
(+)-Rosifoliol
[2R-(2alpha,4abeta,8beta)]-2,3,4,4a,5,6,7,8-octahydro-alpha,alpha,4a,8-tetramethyl-2-naphthalenemethanol		 84.85
C00021857 (E)-beta-Santalal 84.85
C00038054 (-)-Eudesm-7(11)-en-4alpha-ol
Juniper camphor		 84.85
C00046260 Oxyphyllol A
(+)-Oxyphyllol A		 84.85
C00011944 Humbertiol 84.38
C00012003 Shyobunon
Shyobunone		 84.38
C00012004 Epishyobunone 84.38
C00012005 (-)-Elemol
Elemol
alpha-Elemol		 84.38
C00012013 [1S-(1alpha,2beta,3alpha,5alpha)]-2-Ethenyl-2-methyl-3,5-bis(1-methylethenyl)-cyclohexanol 84.38
C00012016 delta-Elemenol
(S,S,S)-(-)-6-Isopropenyl-1-vinyl-p-menth-4-en-2-ol		 84.38
C00012017 Epi-delta-elemenol 84.38
C00012018 (-)-beta-Elemenal
(-)-Elema-1,3,11(13)-trien-12-al		 84.38
C00016958 gamma-Maaliene 84.38
C00021780 delta9(12)-Capnellene 84.38
C00021833 beta-Panasinsene
beta-Panasinsanene		 84.38
C00029881 Calarene
(+)-1(10)-Aristolene		 84.38
C00031626 beta-Elemol 84.38
C00033660 beta-Ylangene 84.38
C00035436 (+)-beta-Isolongibornene 84.38
C00044033 (+)-beta-Copaene 84.38
C00048329 beta-Copaene 84.38
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