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


and

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





INPUT WORD = C00021903 , 50% or more
[ Metabolite Name : trans-alpha-Bergamotene , (Z)-alpha-exo-bergamotol , (-)-exo-alpha-Bergamotene , (E)-alpha-Bergamotene , alpha-trans-Bergamotene , alpha-(E)-Bergamotene ]
Number of matched data : 53

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00029970 cis-alpha-Bergamotene
alpha-cis-bergamotene
100.00
C00048311 alpha-Bergamotene 100.00
C00007630 beta-Sesquiphellandrene 96.77
C00029348 (Z)-alpha-trans-Bergamotol 93.94
C00003118 alpha-Copaene
Copaene
(-)-alpha-Copaene
93.75
C00003203 alpha-Ylangene 93.75
C00011606 beta-Bisabolol 93.75
C00011609 alpha-Bisabol-1-one
1-Bisabolone
93.75
C00011638 (-)-(E)-Lanceol 93.75
C00011640 Curlone
[S-(R*,R*)]-2-Methyl-6-(4-methylene-2-cyclohexen-1-yl)-2-hepten-4-one
93.75
C00021865 Copadiene 93.75
C00029679 alpha-Bisabolol
(-)-Bisabolol
93.75
C00035098 epi-alpha-Bisabolol
(-)-epi-alpha-Bisabolol
93.75
C00011967 Sesquithujene 93.55
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
C00020043 Nephthene 93.55
C00021904 trans-beta-Bergamotene 93.55
C00029672 (-)-alpha-Selinene
alpha-Selinene
93.55
C00030189 epi-alpha-Selinene 93.55
C00035441 (Z)-gamma-Bisabolene 93.55
C00036276 (-)-Eudesma-2,4(15)-11-triene 93.55
C00036298 (+)-alpha-Selinene 93.55
C00038319 7-epi-Sesquithujene 93.55
C00048297 7-epi-alpha-Selinene 93.55
C00012738 (2R-cis)-1,2,3,4,6,7,8,8a-Octahydro-5,8a-dimethyl-3-(1-methylethylidene)-2-naphthalenol 90.91
C00012755 (4aR-cis)-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethylidene)-2(1H)-naphthalenone 90.91
C00011642 (+)-alpha-Atlantone
(E)-alpha-Atlantone
90.63
C00021476 1-Sterpurene 90.63
C00021834 alpha-Panasinsene
alpha-Panasinsanene
90.63
C00021883 alpha-Bourbonene 90.63
C00029678 alpha-Maaliene 90.63
C00036714 alpha-Longipinene
(+)-alpha-Longipinene
90.63
C00044031 (+)-alpha-Copaene 90.63
C00003181 beta-Santalene 90.32
C00003204 alpha-Zingiberene
Zingiberene
(-)-Zingiberene
l-Zingiberene
90.32
C00007242 beta-Bisabolene
(S)-beta-Bisabolene
(-)-beta-Bisabolene
l-beta-Bisabolene
1-Methyl-4-(5-methyl-1-methylene-4-hexenyl)cyclohexene
90.32
C00011412 (3E,5E,8E)-3,7,11-Trimethyldodeca-1,3,5,8,10-pentaene 90.32
C00011634 Isobisabolene 90.32
C00011965 Sesquicarene
[1R-(1a,6a,7a)]-3,7-Dimethyl-7-(4-methyl-3-pentenyl)-bicyclo[4.1.0]hept-2-ene
90.32
C00011966 Sesquisabinene
Sesquisabinene A
90.32
C00012012 (-)-gamma-Elemene
gamma-Elemene
90.32
C00012708 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
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
C00020050 (-)-Zonarene 90.32
C00021589 15-Nor-2-acoren-4-one 90.32
C00030346 gamma-Curcumene 90.32
C00034891 (+)-Sandvicene
Sandvicene
90.32
C00035606 epi-beta-Santalene 90.32
C00036299 (+)-Amorpha-4,11-diene 90.32
C00037113 Epizonarene
(+)-Epizonarene
epi-Zonarene
90.32
C00048532 Selina-3,7-diene 90.32
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