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


and

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




INPUT WORD = C00020180 , 50% or more
[ Metabolite Name : (1S,3R,4R)-Calamenene-3,4,7-triol ]
Number of matched data : 53

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00020774 (1S,3R,4S)-Calamenene-3,4,7-triol 100.00
C00030729 Mansonone O
(-)-Mansonone O		 94.87
C00046123 Mansonone Q
(+)-Mansonone Q		 94.87
C00020168 3,5-Dihydro-8-hydroxy-5-isopropyl-2,7-dimethyl-1-benzoxepin-4(2H)-one 94.59
C00020174 (1S,3R,4S)-Calamenene-3,7-diol 94.59
C00020185 (1S,4S)-7-Methoxycalamenen-3-one 94.59
C00020773 (1S,4R)-7-Methoxycalamenen-4-ol 94.59
C00037239 Heliannuol A
(-)-Heliannuol A		 94.59
C00037241 Heliannuol D
(+)-Heliannuol D		 94.59
C00049723 Heliannuol K
(+)-Heliannuol K		 94.59
C00040054 Populene E
(+)-Populene E		 92.31
C00040055 Populene F
(+)-Populene F		 92.31
C00037249 Helibisabonol A
(-)-Helibisabonol A		 92.11
C00037250 Helibisabonol B 92.11
C00045887 Enokipodin A
(+)-Enokipodin A		 92.11
C00011900 (+/-)-ar-Todomatuic acid
ar-Todomatuic acid
(R)-4-(1,5-Dimethyl-3-oxohexyl)benzoic acid		 91.89
C00012524 Deoxyhelicobasidin 91.89
C00020078 (1R-trans)-1,2,3,4-Tetrahydro-7-hydroxy-6-methyl-4-(1-methylethyl)-1-naphthalenemethanol 91.89
C00020079 3-Hydroxy-14-calamenoic acid 91.89
C00020175 3-Methoxy-8-calamenenol
(1S,3R,4R)-7-Methoxycalamenen-3-ol		 91.89
C00020177 3-Hydroxy-8-calamenenone
(1S,4R)-7-Hydroxycalamenen-3-one		 91.89
C00020179 3-Methoxy-8-calamenenone
(1S,4R)-7-Methoxycalamenen-3-one		 91.89
C00029437 2,7-dihydroxy-11,12-dehydrocalamenene
(-)-2,7-dihydroxy-11,12-dehydrocalamenene		 91.89
C00037244 Heliannuol G
(-)-Heliannuol G		 91.89
C00043340 Canusesnol A
(-)-Canusesnol A		 91.89
C00045888 Enokipodin B
(-)-Enokipodin B		 91.89
C00030728 Mansonone N
(+)-Mansonone N		 90.24
C00020232 3-Hydroxy-6-methoxyprimnatrienone 89.74
C00037243 Heliannuol F
(+)-Heliannuol F		 89.74
C00012553 Aplysinol
[3S-(3alpha,3abeta,8bbeta)]-7-Bromo-1,2,3,8b-tetrahydro-3,6,8b-trimethyl-3aH-cyclopenta[b]benzofuran-3a-methanol		 89.47
C00012554 [3S-(3alpha,3abeta,8bbeta)]-7-Bromo-1,2,3,8b-tetrahydro-3,6,8b-trimethyl-3aH-cyclopenta[b]benzofuran-3a-carboxaldehyde
Aplysinal		 89.47
C00012942 (-)-Yomogin
[3aR-(3aalpha,8abeta,9aalpha)]-3a,8a,9,9a-Tetrahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2,6(3H,4H)-dione		 89.47
C00020097 Heritol 89.47
C00020952 Ferulin 89.47
C00011901 ar-Pseudotsugonal
(R)-4-(1,5-Dimethyl-3-oxohexyl)-benzaldehyde		 89.19
C00020069 3-Hydroxy-beta-calacorene 89.19
C00020116 Lacinilene C 89.19
C00020228 [1S-(1alpha,4alpha,4aalpha,8aalpha)]-1,3,4,4a,5,8a-Hexahydro-1-hydroxy-4,7-dimethyl-1-(1-methylethyl)-2,6-naphthalenedione 89.19
C00020909 Geigeriafulvenolide 89.19
C00030730 Mansonone S 89.19
C00037240 Heliannuol C
(-)-Heliannuol C		 89.19
C00038750 Chlorantene F 89.19
C00042034 10-epi-7,10-epoxy-ar-bisabol-11-ol 89.19
C00042167 7,10-Epoxy-ar-bisabol-11-ol 89.19
C00042682 Laur-11-en-2,10-diol 89.19
C00020178 3-Acetoxy-8-calamenenone
(1S,4R)-7-Acetoxycalamenen-3-one		 87.80
C00037246 Heliannuol I
(-)-Heliannuol I		 87.50
C00039357 Heliannuol J
(+)-Heliannuol J		 87.50
C00045889 Enokipodin C
(-)-Enokipodin C		 87.50
C00020080 3-Methoxy-14-calamenoic acid 87.18
C00020234 6-Methoxy-1,3-primnatrienedione 87.18
C00037247 Heliannuol L 87.18
C00045890 Enokipodin D
(+)-Enokipodin D		 87.18
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