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


and

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




INPUT WORD = C00044887 , 50% or more
[ Metabolite Name : Litseahumulane B , (-)-Litseahumulane B ]
Number of matched data : 97

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00044886 Litseahumulane A
(-)-Litseahumulane A		 97.06
C00012502 Bicyclohumulenedione
[1S-(1R*,5S*,10R*)]-1,5,8,8-tetramethylbicyclo[8.1.0]undecane-2,6-dione		 94.29
C00022013 1,5,8,8-Tetramethyl-8-bicyclo[8.1.0]undecene-2,9-diol 94.29
C00011465 Isodavanone
[2alpha(E),5alpha]-(+)-(5-Ethenyltetrahydro-5-methyl-2-furanyl)-6-methyl-4-hepten-3-one		 94.12
C00011701 [1S-(1R*,4S*,5E,7R*)]-4-Methyl-10-methylene-7-(1-methylethyl)-5-cyclodecene-1,4-diol 94.12
C00012483 (-)-beta-Caryophyllene epoxide
beta-Caryophyllene oxide
(-)-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
C00020641 1beta-Hydroperoxy-4(15),5E,10(14)-germacratriene 94.12
C00021212 Palustrol 94.12
C00021238 Hydroxyalloaromadendrene 94.12
C00021796 Ceratopicanol 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
C00031538 2,9-Humuladien-6-ol-8-one
(-)-2,9-Humuladien-6-ol-8-one		 94.12
C00040307 Sinugibberodiol
(-)-Sinugibberodiol		 94.12
C00044740 Eleganodiol 94.12
C00044885 Litseagermacrane
(+)-Litseagermacrane		 94.12
C00012434 (-)-1,10-Epoxy-4(14)-lepidozen-5-ol
1,10-Epoxy-4(14)-lepidozen-5-ol		 91.67
C00012477 12,12-Dimethyl-9-methylene-5-Oxatricyclo[8.2.0.04,6]dodecane-4-methanol 91.67
C00012484 [1R-(1R*,4R*,6R*,10S*,12R*)]-4,12-Dimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane-12-methanol 91.67
C00021776 Clovane-2beta,9alpha-diol
Cloven-2beta,9alpha-diol
Clovanediol		 91.67
C00022001 Tricyclohumuladiol 91.67
C00041810 Russujaponol D
(-)-Russujaponol D		 91.67
C00046841 Omphadiol
(+)-Omphadiol		 91.67
C00047355 Suberosol B
(-)-Suberosol B		 91.67
C00012460 (1R*,3E,7E,11S*)-(+)-5,5,8-Trimethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene-1-methanol
1alpha,10beta-Epoxy-alpha-humulen-14-ol		 91.43
C00012461 (1R*,3E,7E,11R*)-(+)-5,5,8-Trimethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene-1-carboxaldehyde
6alpha,7beta-Epoxy-2,9-humuladien-14-al		 91.43
C00012486 Lychnophoric acid 91.43
C00012688 Isobrasudol
[2S-(2alpha,4abeta,5beta,8aalpha)]-5-Bromodecahydro-4a-methyl-8-methylene-2-(1-methylethyl)-2-naphthalenol		 91.43
C00012722 7-Hydroxy-beta-costol
(+)-7-Hydroxycostol
Petrovin B
[2S-(2alpha,4abeta,8aalpha)]-Decahydro-2-hydroxy-4a-methyl-b,8-bis(methylene)-2-naphthaleneethanol		 91.43
C00012781 [2R-(2alpha,4aalpha,5alpha,8abeta)]-Decahydro-5-hydroxy-a,a,4a-trimethyl-8-methylene-2-naphthalenemethanol 91.43
C00012790 alpha-Corymbolol
1,[1S-(1alpha,4beta,4aalpha,6beta,8abeta)]-Octahydro-4,8a-dimethyl-6-(1-methylethenyl)-4a(2H)-naphthalenediol		 91.43
C00012791 Corymbolone
[4S-(4alpha,4abeta,6alpha,8aalpha)]-Octahydro-4a-hydroxy-4,8a-dimethyl-6-(1-methylethenyl)-1(2H)-naphthalenone		 91.43
C00021778 Poitediol 91.43
C00021915 Dipterolone 91.43
C00022006 Cyperusol C 91.43
C00037985 Verticillatol
(-)-Verticillatol		 91.43
C00046110 Madolin W 91.43
C00046456 Teclenone B
(+)-Teclenone B		 91.43
C00050331 Artabotrol 91.43
C00000149 Espatulenol
(+)-Spathulenol
Spathulenol		 91.18
C00011443 Davanone 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
C00011724 4(15),5E,10(14)-Germacratrien-1alpha-ol 91.18
C00011733 (+)-Germacrenone
Germacrenone		 91.18
C00011898 Dihydropseudotsugonol 91.18
C00011899 Dihydropseudotsugonal 91.18
C00012463 (+)-Humulenol II
Humulenol
Humulenol II		 91.18
C00012466 (E)-4,4,11-Trimethyl-7-methylene-5-cycloundecen-1-one
1,3(15)-Humuladien-8-one		 91.18
C00012472 14-Hydroxy-9-epi-(beta)-caryophyllene
14-Hydroxy-9-epi-beta-caryophyllene		 91.18
C00012478 Caryophyllenol I 91.18
C00012479 Caryophyllenol II 91.18
C00012490 5-Hydroxy-5,6-secocaryophyllen-6-one 91.18
C00012491 Isokobusone 91.18
C00012492 (-)-Kobusone
Kobusone		 91.18
C00012503 (+)-Bicyclohumulenone
Bicyclohumulenone
[1S-(1R*,5E,10R*)]-1,5,8,8-tetramethylbicyclo[8.1.0]undec-5-en-2-one		 91.18
C00012746 beta-Dictyopterol
(1alpha,4abeta,6alpha,8aalpha)-(+-)-Decahydro-8a-methyl-4-methylene-6-(1-methylethenyl)-1-naphthalenol		 91.18
C00012747 Dictyopterone
Eudesma-4(14),11-dien-1-one		 91.18
C00012748 Isocyperol
(-)-Eudesma-4(14),11-dien-3alpha-ol
[2R-(2alpha,4abeta,7beta,8aalpha)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)-2-naphthalenol		 91.18
C00013572 Torilenol
(1R,1aR,1bS,5R,5aR,6aR)-Decahydro-5a-methyl-2-methylene-1-(1-methylethyl)cycloprop[a]inden-5-ol		 91.18
C00013589 Ent-maaliane-5-ol
(1aS,3aR,7S,7aS,7bR)-Decahydro-1,1,3a,7-tetramethyl-7aH-cyclopropa[a]naphthalen-7a-ol		 91.18
C00016959 (+)-Maaliol
Maaliol
Maali alcohol		 91.18
C00020093 1,4-Epoxycadinane 91.18
C00020378 Epoxyguaiene
1alpha,5alpha-Epoxy-alpha-guaiene		 91.18
C00021300 Isoafricanol 91.18
C00021301 Africanol 91.18
C00021305 Africanone 91.18
C00021322 Marsupellol 91.18
C00021417 Carota-1,4-beta-oxide 91.18
C00021423 1,5-Epoxysalvial-4(14)-ene 91.18
C00021428 Salvial-4(14)-en-1-one
Mintketone		 91.18
C00021474 7-Protoilluden-6-ol 91.18
C00021835 Panasinsanol B 91.18
C00021836 Panasinsanol A 91.18
C00021899 Allohimachalol 91.18
C00021901 4-Ambiguen-1-ol 91.18
C00021969 beta-Caryophyllene alcohol
Caryolan-1-ol		 91.18
C00021970 Cerapicol 91.18
C00021972 Dipterol 91.18
C00021984 Lemnalol 91.18
C00022017 4,11,11-Trimethyltricyclo[6.3.1.02.5]dodec-6-en-8-ol 91.18
C00031765 (-)-ent-Spathulenol
beta-Spathulenol
ent-Spathulenol
(-)-Spathulenol		 91.18
C00033141 Madolin F
(+)-Madolin F		 91.18
C00033674 beta-Copaen-4-alpha-ol 91.18
C00035302 ent-4-epi-Maaliol 91.18
C00036062 Buddledin E 91.18
C00036326 (1R,10R)-Aromadendran-9-one 91.18
C00036333 (1S,10S)-9alpha-Hydroxy-allo-aromadendrane 91.18
C00036334 (1S,10S)-allo-Aromadendran-9-one 91.18
C00040069 Presilphiperfolan-1-ol
(-)-Presilphiperfolan-1-ol		 91.18
C00043752 Nanonorcaryophyllene A
(+)-Nanonorcaryophyllene A		 91.18
C00043753 Nanonorcaryophyllene B
(+)-Nanonorcaryophyllene 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
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