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


and

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




INPUT WORD = C00012490 , 50% or more
[ Metabolite Name : 5-Hydroxy-5,6-secocaryophyllen-6-one ]
Number of matched data : 58

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012483 beta-Caryophyllene oxide
(-)-beta-Caryophyllene epoxide
(-)-Epoxydihydrocaryophyllene
beta-Caryophyllene epoxide
4beta,5alpha-Epoxycaryophyllene
6,7-Epoxy-3(15)-caryophyllene
Caryophyllene 4beta,5alpha-epoxide
trans-Caryophyllene oxide
Betula pubescens
Caryophyllene oxide		 94.12
C00029912 Caryophylladienol I 94.12
C00029913 Caryophylla-4(12),8(13)-dien-5beta-ol
Caryophylladienol II
Caryophylla-4(12),8(13)-dien-5alpha-ol		 94.12
C00030519 Isobonducellin
Isocaryophyllene oxide
(Z)-7-Hydroxy-3-(4'-methoxybenzylidene)chroman-4-one		 94.12
C00030520 CID is old! 94.12
C00012477 12,12-Dimethyl-9-methylene-5-Oxatricyclo[8.2.0.04,6]dodecane-4-methanol 91.67
C00031253 Rumphellolide C
(-)-Rumphellolide C		 91.67
C00012020 Callitrin 91.43
C00012502 Bicyclohumulenedione
[1S-(1R*,5S*,10R*)]-1,5,8,8-tetramethylbicyclo[8.1.0]undecane-2,6-dione		 91.43
C00020184 4-Cadinene-10,14-diol 91.43
C00020245 4-Hydroxy-10(14)-oplopen-3-one 91.43
C00030068 Curcumenone 91.43
C00036365 1,10-Dioxotayloriane
(+)-1,10-Dioxotayloriane		 91.43
C00003161 Ledol
(+)-Ledol		 91.18
C00011472 cis-6-Ethenyldihydro-2,6-dimethyl-2-(4-methyl-3-pentenyl)-2H-pyran-3(4H)-one 91.18
C00011473 (2alpha,3beta,6alpha)-6-Ethenyltetrahydro-2,6-dimethyl-2-(4-methyl-3-pentenyl)-2H-pyran-3-ol 91.18
C00011520 Chokol B 91.18
C00011701 [1S-(1R*,4S*,5E,7R*)]-4-Methyl-10-methylene-7-(1-methylethyl)-5-cyclodecene-1,4-diol 91.18
C00012472 14-Hydroxy-9-epi-beta-caryophyllene 91.18
C00012473 [1S-(1R*,2S*,5E,9S*)]- 6,10,10-Trimethyl-spiro[bicyclo[7.2.0]undec-5-ene-2,2'-oxirane]
3',15-Epoxy-6-caryophyllene		 91.18
C00012478 Caryophyllenol I 91.18
C00012479 Caryophyllenol II 91.18
C00012480 [1S-(1R*,2S*,5E,9S*)]- 6,10,10-Trimethylbicyclo[7.2.0]undec-5-ene-2-carboxaldehyde 91.18
C00012481 [1S-(1R*,2R*,5E,9S*)]-6,10,10-Trimethylbicyclo[7.2.0]undec-5-ene-2-carboxaldehyde 91.18
C00012482 Caryophyllane 2,6-beta-oxide 91.18
C00012491 Isokobusone 91.18
C00012492 (-)-Kobusone
Kobusone		 91.18
C00021212 Palustrol 91.18
C00022020 Waitziacuminone 91.18
C00031256 Rumphellolide F
(-)-Rumphellolide F		 91.18
C00031538 2,9-Humuladien-6-ol-8-one
(-)-2,9-Humuladien-6-ol-8-one		 91.18
C00034985 (+)-Globulol 91.18
C00036062 Buddledin E 91.18
C00040069 Presilphiperfolan-1-ol
(-)-Presilphiperfolan-1-ol		 91.18
C00040741 (-)-Ledol 91.18
C00040827 4,5-Epoxy-13-hydroxy-beta-caryophyllene 91.18
C00042019 (Z)-1beta-hydroxy-2-hydrolanceol 91.18
C00042556 Gibberodione
(+)-Gibberodione		 91.18
C00043752 Nanonorcaryophyllene A
(+)-Nanonorcaryophyllene A		 91.18
C00043753 Nanonorcaryophyllene B
(+)-Nanonorcaryophyllene B		 91.18
C00044887 Litseahumulane B
(-)-Litseahumulane B		 91.18
C00046584 4,5-Dihydro-beta-caryophyllene-14-al
(-)-4,5-Dihydro-beta-caryophyllene-14-al		 91.18
C00048351 Caryophylla-4(14),8(15)-dien-5alpha-ol 91.18
C00022011 3,7-Epoxycaryophyllane-5alpha,15-diol 89.47
C00022012 7,15-epoxycaryophyllane-3,5beta-diol 89.47
C00003155 Isovelleral 88.89
C00012484 [1R-(1R*,4R*,6R*,10S*,12R*)]-4,12-Dimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane-12-methanol 88.89
C00012501 Punctaporonin G
[1S-(1a,4b,9a)]-2,2,9-Trimethyl-12-oxatricyclo[7.2.1.01,4]dodeca-5,7-diene-5-methanol		 88.89
C00017494 2,5-Epoxy-1(6)-brasilen-9-ol 88.89
C00020422 alpha-Kessyl alcohol 88.89
C00020914 Elehirtanolide 88.89
C00021116 4beta,10alpha-Dihydroxyaromadendrane
(-)-4beta,10alpha-Dihydroxyaromadendrane
Aromadendrane-4beta,10alpha-diol		 88.89
C00021207 Alloaromadendrane-4alpha,10beta-diol 88.89
C00022001 Tricyclohumuladiol 88.89
C00031608 Aromadendrane-4beta,10beta-diol 88.89
C00035096 ent-4beta,10alpha-Dihydroxyaromadendrane 88.89
C00037367 Kanshone G
(-)-Kanshone G		 88.89
C00047355 Suberosol B
(-)-Suberosol B		 88.89
Page Top