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


and

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




INPUT WORD = C00048434 , 50% or more
[ Metabolite Name : Isogermacrene D , (-)-Isogermacrene D ]
Number of matched data : 55

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00011720 (-)-Germacrene D
Germacrene D
(+)-germacrene D		 96.67
C00020379 alpha-Bulnesene
delta-Guaiene		 93.55
C00020383 gamma-gurjunene epoxide
(+)-gamma-Gurjunene
gamma-Gurjunene		 93.55
C00011507 (E)-6,10-Dimethyl-9-methylene-5-undecen-2-one 93.33
C00011719 (-)-Germacrene A
Germacrene A		 93.33
C00011721 (-)-Helminthogermacrene
Helminthogermacrene		 93.33
C00012423 (-)-Noranthoplone
Noranthoplone		 93.33
C00012454 gamma-Humulene
Isohumulene		 93.33
C00011711 [1R-(1R*,2E,4R*,7E)]-1,7-Dimethyl-4-(1-methylethyl)-2,7-cyclodecadien-1-ol 90.63
C00011713 (-)-1(10)E,5E-Germacradien-4-ol
[1S-(1R*,2E,4R*,7E)]-1,7-Dimethyl-4-(1-methylethyl)-2,7-cyclodecadien-1-ol
(-)-1(10),5-Germacradien-4-ol		 90.63
C00011714 Preisocalamendiol
Preisocalamenediol		 90.63
C00011726 4(15),5E,10(14)-Germacratrien-1-one 90.63
C00034456 beta-Gurjunene 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
C00011421 Fokienol
(E,E)-3,7,11-trimethyl-1,6,9,11-Dodecatetraen-3-ol		 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
C00020043 Nephthene 90.32
C00020044 (-)-epsilon-Bulgarene 90.32
C00020063 1-Epibicyclosesquiphellandrene
(+)-epi-Bicyclosesquiphellandrene		 90.32
C00020136 Bicyclosesquiphellandrene 90.32
C00020377 alpha-Guaiene
Guaia-1(5),11-diene		 90.32
C00029672 (-)-alpha-Selinene
alpha-Selinene		 90.32
C00030189 epi-alpha-Selinene 90.32
C00034387 3,9-Dimethyl-6-isopropyl-2E,7E,9-decatrienal 90.32
C00036276 (-)-Eudesma-2,4(15)-11-triene 90.32
C00036288 (-)-Selina-4-11-diene 90.32
C00036298 (+)-alpha-Selinene 90.32
C00037126 Eudesma-4,11-diene
(+)-Selina-4,11-diene
Selina-4,11-diene		 90.32
C00037222 Guaiane 90.32
C00044032 (+)-beta-Caryophyllene 90.32
C00048297 7-epi-alpha-Selinene 90.32
C00003131 E-beta-farnesene
trans-beta-Farnesene
(E)-beta-Farnesene
beta-Farnesene
(E)-beta-Famesene
beta-trans-Farnesene		 90.00
C00003134 Germacrene B
germacrene-B		 90.00
C00003147 alpha-Caryophyllene (obsol.)
alpha-Caryophyllene
alpha-Humulene
Humulene
(+/-)-alpha-Humulene		 90.00
C00007453 beta-Elemene
Cyclohexane		 90.00
C00011411 2,6,10-Trimethyldodecane
Farnesane		 90.00
C00012470 (E,E)-4,4,8-Trimethyl-2,8-cycloundecadien-1-one
Rudbeckianone		 90.00
C00035434 (-)-cis-beta-Elemene 90.00
C00036271 (-)-beta-Elemene 90.00
C00050105 Germacrene E 90.00
C00011697 Angrendiol 88.24
C00000163 alpha-Eudesmol 87.88
C00012438 (-)-Lepidoza-1(10),4(14)-dien-5-ol
Lepidoza-1(10),4(14)-dien-5-ol		 87.88
C00012810 Rosifoliol
(+)-Rosifoliol
[2R-(2alpha,4abeta,8beta)]-2,3,4,4a,5,6,7,8-octahydro-alpha,alpha,4a,8-tetramethyl-2-naphthalenemethanol		 87.88
C00020408 [3R-(3alpha,5beta,8alpha,8abeta)]-1,2,3,5,6,7,8,8a-Octahydro-alpha,alpha,3,8-tetramethyl-5-szulenemethanol 87.88
C00029865 Bullnesol
Bulnesol		 87.88
C00037125 Eudesm-4(15)-en-7-ol
(+)-Eudesm-4(15)-en-7alpha-ol		 87.88
C00037220 Guai-5-en-11-ol
(-)-Ent-5-guaien-11-ol		 87.88
C00049098 7-epi-beta-Eudesmol 87.88
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