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


and

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




INPUT WORD = C00012478 , 50% or more
[ Metabolite Name : Caryophyllenol I ]
Number of matched data : 59

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012479 Caryophyllenol II 100.00
C00029912 Caryophylladienol I 96.97
C00029913 Caryophylla-4(12),8(13)-dien-5beta-ol
Caryophylladienol II
Caryophylla-4(12),8(13)-dien-5alpha-ol		 96.97
C00048855 Sinunorcaryophyllenol 96.97
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
C00021474 7-Protoilluden-6-ol 94.12
C00030519 Isobonducellin
Isocaryophyllene oxide
(Z)-7-Hydroxy-3-(4'-methoxybenzylidene)chroman-4-one		 94.12
C00030520 CID is old! 94.12
C00044886 Litseahumulane A
(-)-Litseahumulane A		 94.12
C00012472 14-Hydroxy-9-epi-beta-caryophyllene 93.94
C00012491 Isokobusone 93.94
C00012740 Cyperol 93.94
C00020059 10beta,15-Epoxykhusinol
1beta,6alpha,7betaH-Cadina-4,10(15)-dien-3alpha-ol		 93.94
C00023989 Trichoacorenol
(1S,4S,5S,7R)-1-Isopropyl-4,8-dimethylspiro[4.5]dec-8-en-7-ol		 93.94
C00036062 Buddledin E 93.94
C00043753 Nanonorcaryophyllene B
(+)-Nanonorcaryophyllene B		 93.94
C00045355 Muurola-4,10(14)-dien-3-one
(-)-Muurola-4,10(14)-dien-3-one		 93.94
C00046584 4,5-Dihydro-beta-caryophyllene-14-al
(-)-4,5-Dihydro-beta-caryophyllene-14-al		 93.94
C00048351 Caryophylla-4(14),8(15)-dien-5alpha-ol 93.94
C00012490 5-Hydroxy-5,6-secocaryophyllen-6-one 91.18
C00012492 (-)-Kobusone
Kobusone		 91.18
C00021212 Palustrol 91.18
C00021238 Hydroxyalloaromadendrene 91.18
C00021796 Ceratopicanol 91.18
C00021835 Panasinsanol B 91.18
C00021836 Panasinsanol A 91.18
C00021969 beta-Caryophyllene alcohol 91.18
C00022017 4,11,11-Trimethyltricyclo[6.3.1.02.5]dodec-6-en-8-ol 91.18
C00040069 Presilphiperfolan-1-ol
(-)-Presilphiperfolan-1-ol		 91.18
C00043752 Nanonorcaryophyllene A
(+)-Nanonorcaryophyllene A		 91.18
C00044887 Litseahumulane B
(-)-Litseahumulane B		 91.18
C00003183 beta-Santalol
(E)-beta-Santalol		 90.91
C00011446 [2S-[2alpha,5alpha(E)]]-5-(1,5-Dimethyl-1,4-hexadienyl)-2-ethenyltetrahydro-2-methylfuran 90.91
C00011447 [2S-[2alpha,5beta(E)]]-5-(1,5-Dimethyl-1,4-hexadienyl)-2-ethenyltetrahydro-2-methylfuran 90.91
C00011724 4(15),5E,10(14)-Germacratrien-1alpha-ol 90.91
C00012463 (+)-Humulenol II
Humulenol
Humulenol II		 90.91
C00012466 (E)-4,4,11-Trimethyl-7-methylene-5-cycloundecen-1-one
1,3(15)-Humuladien-8-one		 90.91
C00012480 [1S-(1R*,2S*,5E,9S*)]- 6,10,10-Trimethylbicyclo[7.2.0]undec-5-ene-2-carboxaldehyde 90.91
C00012481 [1S-(1R*,2R*,5E,9S*)]-6,10,10-Trimethylbicyclo[7.2.0]undec-5-ene-2-carboxaldehyde 90.91
C00012488 Buddledin C 90.91
C00012489 Buddledin D 90.91
C00012503 (+)-Bicyclohumulenone
Bicyclohumulenone
[1S-(1R*,5E,10R*)]-1,5,8,8-tetramethylbicyclo[8.1.0]undec-5-en-2-one		 90.91
C00012746 beta-Dictyopterol
(1alpha,4abeta,6alpha,8aalpha)-(+-)-Decahydro-8a-methyl-4-methylene-6-(1-methylethenyl)-1-naphthalenol		 90.91
C00012747 Dictyopterone
Eudesma-4(14),11-dien-1-one		 90.91
C00012748 Isocyperol
(-)-Eudesma-4(14),11-dien-3alpha-ol
[2R-(2alpha,4abeta,7beta,8aalpha)]-Decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)-2-naphthalenol		 90.91
C00012759 (+)-alpha-Cyperone
Eudesma-4,11-dien-3-one
(4aS-cis)-4,4a,5,6,7,8-Hexahydro-1,4a-dimethyl-7-(1-methylethenyl)-2(3H)-naphthalenone		 90.91
C00013554 [1R-(1alpha,3abeta,4beta,7aalpha)]-Octahydro-3a-methyl-7-methylene-1-(2-methyl-2-propenyl)-1H-inden-4-ol 90.91
C00020250 alpha-Oplopenone 90.91
C00021296 10-Epivalerenol 90.91
C00021428 Salvial-4(14)-en-1-one
Mintketone		 90.91
C00021584 Shizuka-acoradienol 90.91
C00021799 Pentalenene 90.91
C00021833 beta-Panasinsene
beta-Panasinsanene		 90.91
C00021857 (E)-beta-Santalal 90.91
C00021899 Allohimachalol 90.91
C00021901 4-Ambiguen-1-ol 90.91
C00032374 Artemisinic alcohol
trans-Arteannuic alcohol		 90.91
C00035798 Acorenone
(-)-Acorenone		 90.91
C00040179 Rupestrenol
(+)-Rupestrenol		 90.91
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