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


and

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




INPUT WORD = C00012455 , 50% or more
[ Metabolite Name : beta-Humulene ]
Number of matched data : 78

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00003147 alpha-Caryophyllene (obsol.)
alpha-Caryophyllene
alpha-Humulene
Humulene
(+/-)-alpha-Humulene		 96.67
C00011722 beta-Germacrene C
(E,E)-1-Methyl-7-methylene-4-(1-methylethyl)-1,3-cyclodecadiene		 96.67
C00012459 (Z,E,E)-5,8,8-Trimethyl-1,5,9-cycloundecatriene-1-carboxaldehyde
alpha-Humulen-14-al		 93.75
C00012463 (+)-Humulenol II
Humulenol
Humulenol II		 93.75
C00021226 4-Aromadendrene 93.75
C00021227 alpha-Gurjunene 93.75
C00021982 Italicene 93.75
C00036063 Buddledone A 93.75
C00038071 (+)-alpha-Gurjunene 93.75
C00012425 (+)-Bicyclogermacrene
Bicyclogermacren
Bicyclogermacrene
Biclyclogermacrene		 93.55
C00020042 gamma-Bulgarene 93.55
C00020130 gamma-Muurolene
1beta-Cadina-4,10(15)-diene		 93.55
C00020384 6,9-Guaiadiene 93.55
C00021308 beta-Himachalene 93.55
C00021309 alpha-Himachalene 93.55
C00021310 gamma-Himachalene 93.55
C00021582 alpha-Acoradiene
(-)-alpha-Acoradiene		 93.55
C00034461 Cadina-1(6),4-diene 93.55
C00036272 (-)-Bicyclogermacrene
ent-Bicyclogermacrene		 93.55
C00037322 Isobicyclogermacrene
(+)-Isobicyclogermacrene		 93.55
C00038052 (-)-cis-Cadina-1(6),4-diene 93.55
C00011411 2,6,10-Trimethyldodecane
Farnesane		 93.33
C00012454 gamma-Humulene
Isohumulene		 93.33
C00003145 Himachalol 90.91
C00012503 (+)-Bicyclohumulenone
Bicyclohumulenone
[1S-(1R*,5E,10R*)]-1,5,8,8-tetramethylbicyclo[8.1.0]undec-5-en-2-one		 90.91
C00021899 Allohimachalol 90.91
C00021901 4-Ambiguen-1-ol 90.91
C00003120 alpha-Cubebene 90.63
C00011730 [S-(E)]-4-Methyl-10-methylene-7-(1-methylethenyl)-4-cyclodecen-1-one 90.63
C00012466 (E)-4,4,11-Trimethyl-7-methylene-5-cycloundecen-1-one
1,3(15)-Humuladien-8-one		 90.63
C00012467 Zerumbone 90.63
C00016958 gamma-Maaliene 90.63
C00021230 (+)-Aromadendrene
Aromadendrene
(+)-Aromadendr-7(15)-ene		 90.63
C00021286 alpha-Patchoulene 90.63
C00021476 1-Sterpurene 90.63
C00021758 Tricyclovetivene
Zizaene
Khusimene		 90.63
C00021772 (+)-Prezizaene 90.63
C00021773 (-)-Prezizaene 90.63
C00021825 6-Silphiperfolene 90.63
C00021833 beta-Panasinsene
beta-Panasinsanene		 90.63
C00029395 14-Hydroxy-alpha-humulene 90.63
C00029817 (-)-beta-Longipinene
beta-Longipinene		 90.63
C00029818 beta-Maaliene 90.63
C00035627 Ginsinsene 90.63
C00035723 Panaginsene 90.63
C00037332 Isoledene
(-)-Isoledene		 90.63
C00003110 beta-Caryophyllene
(E)-beta-Caryophyllene
caryophyllene
Caryophyllene
(E)-Caryophyllene
(-)-(E)-Caryophyllene
trans-Caryophyllene
trans-beta-Caryophyllene		 90.32
C00003186 beta-Eudesmene
beta-Selinene		 90.32
C00011971 Bicycloelemene
(-)-Bicycloelemene
3-Ethenyl-3,7,7-trimethyl-2-(1-methylethenyl)bicyclo[4.1.0]heptane		 90.32
C00012471 (+)-9-epi-beta-Caryophyllene
9-epi-(E)-Caryophyllene		 90.32
C00012474 Isocaryophyllene
(-)-Isocaryophyllene
(Z)-Caryophyllene
gamma-Caryophyllen
cis-Caryophyllene		 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
C00016965 (+)-beta-Gorgonene
beta-Gorgonen
beta-Gorgonene		 90.32
C00017520 Amorpha-4,11-diene
(-)-Amorpha-4,11-diene
4,11-Amorphadiene
Amorphadiene		 90.32
C00020041 beta1-Bulgarene
4,9-Bulgaradiene		 90.32
C00020044 (-)-epsilon-Bulgarene 90.32
C00020049 gamma2-Cadinene
3,10(14)-Cadinadiene		 90.32
C00020063 1-Epibicyclosesquiphellandrene
(+)-epi-Bicyclosesquiphellandrene		 90.32
C00020136 Bicyclosesquiphellandrene 90.32
C00020377 alpha-Guaiene
Guaia-1(5),11-diene		 90.32
C00021380 Daucene 90.32
C00021580 beta-Acoradiene 90.32
C00021583 4(15),5-Acoradiene 90.32
C00021777 Precapnelladiene 90.32
C00030345 gamma-Cadinene 90.32
C00030434 Guaia-6,9-diene
(+)-Guaia-6,9-diene		 90.32
C00034387 3,9-Dimethyl-6-isopropyl-2E,7E,9-decatrienal 90.32
C00034408 CID is old! 90.32
C00035724 Panaxene 90.32
C00035802 alpha-Neocallitropsene
(-)-alpha-Neocallitropsene		 90.32
C00035828 gamma-Amorphene
(+)-gamma-Amorphene		 90.32
C00036269 (-)-Amorpha-4,7(11)-diene 90.32
C00036278 (-)-gamma-Cadinene 90.32
C00037222 Guaiane 90.32
C00044032 (+)-beta-Caryophyllene 90.32
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