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


and

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




INPUT WORD = C00048311 , 50% or more
[ Metabolite Name : alpha-Bergamotene ]
Number of matched data : 56

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00021903 trans-alpha-Bergamotene
(Z)-alpha-exo-bergamotol
(-)-exo-alpha-Bergamotene
(E)-alpha-Bergamotene
alpha-trans-Bergamotene
alpha-(E)-Bergamotene		 100.00
C00029970 cis-alpha-Bergamotene
alpha-cis-bergamotene		 100.00
C00029348 (Z)-alpha-trans-Bergamotol 93.94
C00003118 alpha-Copaene
Copaene
(-)-alpha-Copaene		 93.75
C00003203 alpha-Ylangene 93.75
C00011607 (-)-alpha-Bisabolol 93.75
C00011628 [S-[R*,S*-(E)]]-2-Methyl-6-(4-methylene-2-cyclohexen-1-yl)-2-heptenal 93.75
C00021865 Copadiene 93.75
C00011631 E-gamma-Bisabolene
(E)-4-(1,5-Dimethyl-4-hexenylidene)-1-methyl-cyclohexene
(E)-gamma-Bisabolene
trans-gamma-Bisabolene		 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
C00020063 1-Epibicyclosesquiphellandrene
(+)-epi-Bicyclosesquiphellandrene		 93.55
C00020136 Bicyclosesquiphellandrene 93.55
C00021577 delta-Acoradiene 93.55
C00021581 gamma-Acoradiene
(-)-alpha-Alaskene		 93.55
C00021583 4(15),5-Acoradiene 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
C00036269 (-)-Amorpha-4,7(11)-diene 93.55
C00036276 (-)-Eudesma-2,4(15)-11-triene 93.55
C00036298 (+)-alpha-Selinene 93.55
C00048297 7-epi-alpha-Selinene 93.55
C00011650 Bisabolene oxide 90.91
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
C00011604 Zingiberenol 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
C00050265 (Z)-gamma-Atlantone
Z-gamma-Atlantone		 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
C00020042 gamma-Bulgarene 90.32
C00020130 gamma-Muurolene
1beta-Cadina-4,10(15)-diene		 90.32
C00020383 gamma-gurjunene epoxide
(+)-gamma-Gurjunene
gamma-Gurjunene		 90.32
C00021576 Acoradinene 90.32
C00021579 (+)-Acora-4(14),8-diene 90.32
C00021582 alpha-Acoradiene
(-)-alpha-Acoradiene		 90.32
C00030346 gamma-Curcumene 90.32
C00034461 Cadina-1(6),4-diene 90.32
C00034891 (+)-Sandvicene
Sandvicene		 90.32
C00035606 epi-beta-Santalene 90.32
C00048532 Selina-3,7-diene 90.32
Page Top