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


and

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




INPUT WORD = C00036062 , 50% or more
[ Metabolite Name : Buddledin E ]
Number of matched data : 61

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00048351 Caryophylla-4(14),8(15)-dien-5alpha-ol 100.00
C00012472 14-Hydroxy-9-epi-beta-caryophyllene 96.97
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
C00046584 4,5-Dihydro-beta-caryophyllene-14-al
(-)-4,5-Dihydro-beta-caryophyllene-14-al		 96.97
C00021835 Panasinsanol B 94.12
C00021836 Panasinsanol A 94.12
C00021969 beta-Caryophyllene alcohol 94.12
C00021972 Dipterol 94.12
C00022017 4,11,11-Trimethyltricyclo[6.3.1.02.5]dodec-6-en-8-ol 94.12
C00012466 (E)-4,4,11-Trimethyl-7-methylene-5-cycloundecen-1-one
1,3(15)-Humuladien-8-one		 93.94
C00012478 Caryophyllenol I 93.94
C00012479 Caryophyllenol II 93.94
C00012480 [1S-(1R*,2S*,5E,9S*)]- 6,10,10-Trimethylbicyclo[7.2.0]undec-5-ene-2-carboxaldehyde 93.94
C00012481 [1S-(1R*,2R*,5E,9S*)]-6,10,10-Trimethylbicyclo[7.2.0]undec-5-ene-2-carboxaldehyde 93.94
C00012488 Buddledin C 93.94
C00012489 Buddledin D 93.94
C00012491 Isokobusone 93.94
C00017491 2-Epibrasilenol
Epibrasilenol		 93.94
C00021833 beta-Panasinsene
beta-Panasinsanene		 93.94
C00043753 Nanonorcaryophyllene B
(+)-Nanonorcaryophyllene B		 93.94
C00022016 4,11,11-Trimethyltricyclo[6.3.1.02.5]dodecane-6,8-diol 91.67
C00012486 Lychnophoric acid 91.43
C00021915 Dipterolone 91.43
C00000149 Espatulenol
(+)-Spathulenol
Spathulenol		 91.18
C00003123 Cycloeudesmol 91.18
C00003161 Ledol
(+)-Ledol		 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
C00012482 Caryophyllane 2,6-beta-oxide 91.18
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		 91.18
C00012490 5-Hydroxy-5,6-secocaryophyllen-6-one 91.18
C00013573 Isocycloeudesmol
Hexahydro-alpha,alpha,3a,7-tetramethyl-1H-cycloprop[c]indene-1a(2H)-methanol		 91.18
C00016959 (+)-Maaliol
Maaliol
Maali alcohol		 91.18
C00021212 Palustrol 91.18
C00021213 (-)-Globulol
Globulol		 91.18
C00021217 Viridiflorol
Himbaccol		 91.18
C00021238 Hydroxyalloaromadendrene 91.18
C00021287 Patchoulenone
8-Oxocyperene		 91.18
C00021300 Isoafricanol 91.18
C00021301 Africanol 91.18
C00021302 Leptographiol 91.18
C00021303 Isoleptographiol 91.18
C00021766 Jinkohol II 91.18
C00021796 Ceratopicanol 91.18
C00021820 6-Silphiperfolanol 91.18
C00021827 Presilphiperfolanol 91.18
C00022018 4,11,11-Trimethyltricyclo[6.3.1.02.5]dodec-7-en-6-ol 91.18
C00022019 Vulgarone A 91.18
C00030519 Isobonducellin
Isocaryophyllene oxide
(Z)-7-Hydroxy-3-(4'-methoxybenzylidene)chroman-4-one		 91.18
C00030520 CID is old! 91.18
C00031256 Rumphellolide F
(-)-Rumphellolide F		 91.18
C00031765 (-)-ent-Spathulenol
beta-Spathulenol
ent-Spathulenol
(-)-Spathulenol		 91.18
C00034985 (+)-Globulol 91.18
C00035302 ent-4-epi-Maaliol 91.18
C00035570 Cyclosantalal 91.18
C00035608 epi-Cyclosantalal
Epicyclosantalal		 91.18
C00035896 Vulgarol B 91.18
C00038056 (-)-Longiborneol 91.18
C00040069 Presilphiperfolan-1-ol
(-)-Presilphiperfolan-1-ol		 91.18
C00040827 4,5-Epoxy-13-hydroxy-beta-caryophyllene 91.18
C00044887 Litseahumulane B
(-)-Litseahumulane B		 91.18
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