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


and

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




INPUT WORD = C00020166 , 50% or more
[ Metabolite Name : Calacone ]
Number of matched data : 69

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00011629 Gratissimene 90.63
C00012016 delta-Elemenol
(S,S,S)-(-)-6-Isopropenyl-1-vinyl-p-menth-4-en-2-ol		 90.63
C00012017 Epi-delta-elemenol 90.63
C00011714 Preisocalamendiol
Preisocalamenediol		 87.50
C00011724 4(15),5E,10(14)-Germacratrien-1alpha-ol 87.50
C00012011 delta-Elemene 87.50
C00012466 (E)-4,4,11-Trimethyl-7-methylene-5-cycloundecen-1-one
1,3(15)-Humuladien-8-one		 87.50
C00021380 Daucene 87.50
C00021757 Khusimone 87.50
C00012788 (-)-Oplodiol
Oplodiol
[1S-(1alpha,4alpha,4aalpha,8abeta)]-1,2,3,4,4a,5,8,8a-Octahydro-1,4a-dimethyl-7-(1-methylethyl)-1,4-naphthalenediol		 85.71
C00013589 Ent-maaliane-5-ol
(1aS,3aR,7S,7aS,7bR)-Decahydro-1,1,3a,7-tetramethyl-7aH-cyclopropa[a]naphthalen-7a-ol		 85.29
C00036326 (1R,10R)-Aromadendran-9-one 85.29
C00036333 (1S,10S)-9alpha-Hydroxy-allo-aromadendrane 85.29
C00036334 (1S,10S)-allo-Aromadendran-9-one 85.29
C00038050 (-)-Aromadendran-5-ol 85.29
C00043946 Swartzianin B
(-)-Swartzianin B		 85.29
C00012444 Humulene 1,2-epoxide
Humulene epoxide II
(-)-Humulene epoxide II
Humulene 6,7-epoxide
Humulene II epoxide
Humulene oxide II		 84.85
C00012742 (+)-gamma-Costol
gamma-Costol
(2R-cis)-1,2,3,4,4a,5,6,7-Octahydro-4a,8-dimethyl-beta-methylene-2-naphthaleneethanol		 84.85
C00012746 beta-Dictyopterol
(1alpha,4abeta,6alpha,8aalpha)-(+-)-Decahydro-8a-methyl-4-methylene-6-(1-methylethenyl)-1-naphthalenol		 84.85
C00012747 Dictyopterone
Eudesma-4(14),11-dien-1-one		 84.85
C00012748 Isocyperol
(-)-Eudesma-4(14),11-dien-3alpha-ol
[2R-(2alpha,4abeta,7beta,8aalpha)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)-2-naphthalenol		 84.85
C00012749 (+)-beta-Costol
(+)-Costol
beta-Costol
Sesquibenihiol
Eudesma-4(14),11(13)-dien-12-ol
[2R-(2alpha,4aalpha,8abeta)]-Decahydro-4a-methyl-b,8-bis(methylene)-2-naphthaleneethanol		 84.85
C00012750 (+)-Costal
Costic aldehyde
(+)-beta-Costal
Eudesma-4(14),11(13)-dien-12-al		 84.85
C00012753 (+)-Coralloidin E
Coralloidin E
trans-(+)-4,4a,5,6,7,8-Hexahydro-alpha,alpha,4a,8-tetramethyl-2-naphthalenemethanol		 84.85
C00013554 [1R-(1alpha,3abeta,4beta,7aalpha)]-Octahydro-3a-methyl-7-methylene-1-(2-methyl-2-propenyl)-1H-inden-4-ol 84.85
C00016998 (+)-Valencenol
Valencenol		 84.85
C00017005 Eremofukinone 84.85
C00017491 2-Epibrasilenol
Epibrasilenol		 84.85
C00020073 5-Hydroxycalamenene 84.85
C00020254 Jungianol 84.85
C00020397 Rotundone 84.85
C00021298 Valerenenol 84.85
C00021299 Isovalerenenol 84.85
C00021902 Bazzanenol 84.85
C00021924 Isohimachalone 84.85
C00029912 Caryophylladienol I 84.85
C00029913 Caryophylla-4(12),8(13)-dien-5beta-ol
Caryophylladienol II
Caryophylla-4(12),8(13)-dien-5alpha-ol		 84.85
C00046149 Millecrone A 84.85
C00007635 CID is old! 84.38
C00011622 (R)-(-)-Xanthorrhizol
(R)-5-(1,5-Dimethyl-4-hexenyl)-o-cresol
Xanthorrhizol		 84.38
C00011626 2-Methyl-6-(4-methylphenyl)-1-hepten-3-one
1,3,5,11-Bisabolatetraen-10-one		 84.38
C00011627 1,3,5-Bisabolatrien-10-one
2-Methyl-6-(4-methylphenyl)-3-heptanone		 84.38
C00011709 Acoragermacrone 84.38
C00011715 Periplanone C
Periplanone D1		 84.38
C00011716 (-)-Periplanone D
Periplanone D
Periplanone D2		 84.38
C00011726 4(15),5E,10(14)-Germacratrien-1-one 84.38
C00011728 Germacrone
(E,E)-Germacrone
Germacron		 84.38
C00011730 [S-(E)]-4-Methyl-10-methylene-7-(1-methylethenyl)-4-cyclodecen-1-one 84.38
C00012002 Shyobunol
[1R-(1alpha,2alpha,3beta,6alpha)]-3-Mthenyl-3-methyl-2-(1-methylethenyl)-6-(1-methylethyl)-cyclohexanol		 84.38
C00012003 Shyobunon
Shyobunone		 84.38
C00012004 Epishyobunone 84.38
C00012005 Elemol
alpha-Elemol
(-)-Elemol		 84.38
C00012013 [1S-(1alpha,2beta,3alpha,5alpha)]-2-Ethenyl-2-methyl-3,5-bis(1-methylethenyl)-cyclohexanol 84.38
C00012018 (-)-beta-Elemenal
(-)-Elema-1,3,11(13)-trien-12-al		 84.38
C00012463 (+)-Humulenol II
Humulenol
Humulenol II		 84.38
C00012464 (+)-Humulenol I
Humulenol I		 84.38
C00012465 (E,E)-2,9,9-Trimethyl-6-methylene-2,7-cycloundecadien-1-one
gamma-Humulen-9-one		 84.38
C00016975 Eremophilene 84.38
C00020050 (-)-Zonarene 84.38
C00029559 (+)-5-epi-Aristolochene
5-epi-Aristolochene
(+)-Epiaristolochene		 84.38
C00030346 gamma-Curcumene 84.38
C00031626 beta-Elemol 84.38
C00034741 Valencene 84.38
C00035539 beta-Isocyclolavandulyl isobutyrate 84.38
C00036063 Buddledone A 84.38
C00036290 (-)-Tamariscene
Tamariscene		 84.38
C00036316 (+)-Pacifigorgia-1(6),10-diene 84.38
C00048825 Polydactin A 84.38
C00049150 epi-Swartzianin A
(-)-epi-Swartzianin A		 84.38
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