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


and

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




INPUT WORD = C00020178 , 50% or more
[ Metabolite Name : 3-Acetoxy-8-calamenenone , (1S,4R)-7-Acetoxycalamenen-3-one ]
Number of matched data : 68

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00020131 3-Acetoxy-2-hydroxycalamenene 97.56
C00011688 3-(Acetyloxy)-5-(1,5-dimethyl-4-hexenyl)-2-methyl-2,5-cyclohexadiene-1,4-dione 90.48
C00012507 (R)-4-Bromo-2-methyl-5-(1,2,2-trimethyl-3-cyclopenten-1-yl)phenol acetate
Cupalaurenol acetate		 90.24
C00020175 3-Methoxy-8-calamenenol
(1S,3R,4R)-7-Methoxycalamenen-3-ol		 90.24
C00020179 3-Methoxy-8-calamenenone
(1S,4R)-7-Methoxycalamenen-3-one		 90.24
C00030728 Mansonone N
(+)-Mansonone N		 90.24
C00012536 [1S-(1alpha,2beta,5alpha)]-4-Bromo-5-(1,2-dimethylbicyclo[3.1.0]hex-2-yl)-2-methylphenol acetate
Cyclolaurenol acetate		 88.10
C00002995 Heritonin 87.80
C00012571 Laurenol acetate 87.80
C00020080 3-Methoxy-14-calamenoic acid 87.80
C00020180 (1S,3R,4R)-Calamenene-3,4,7-triol 87.80
C00020185 (1S,4S)-7-Methoxycalamenen-3-one 87.80
C00020229 8beta-Acetoxy-9beta-hydroxyverboccidenten 87.80
C00020232 3-Hydroxy-6-methoxyprimnatrienone 87.80
C00020773 (1S,4R)-7-Methoxycalamenen-4-ol 87.80
C00020774 (1S,3R,4S)-Calamenene-3,4,7-triol 87.80
C00003158 Lacinilene C 7-methyl ether 85.37
C00011615 (E)-2-(1,5-Dimethyl-1,4-hexadienyl)-5-methyl-phenol acetate 85.37
C00011686 O-Methylperezone
(-)-2-(1,5-Dimethyl-4-hexenyl)-3-methoxy-5-methyl-p-benzoquinone		 85.37
C00011702 [1S-(1R*,4S*,5E,7R*)]-4-Methyl-10-methylene-7-(1-methylethyl)-1-acetate 5-cyclodecene-1,4-diol 85.37
C00011900 (+/-)-ar-Todomatuic acid
ar-Todomatuic acid
(R)-4-(1,5-Dimethyl-3-oxohexyl)benzoic acid		 85.37
C00020079 3-Hydroxy-14-calamenoic acid 85.37
C00020097 Heritol 85.37
C00020111 3-Acetoxy-4,7(11)-muuroladien-8-one 85.37
C00020158 Ryomenin 85.37
C00020168 3,5-Dihydro-8-hydroxy-5-isopropyl-2,7-dimethyl-1-benzoxepin-4(2H)-one 85.37
C00020174 (1S,3R,4S)-Calamenene-3,7-diol 85.37
C00020234 6-Methoxy-1,3-primnatrienedione 85.37
C00030729 Mansonone O
(-)-Mansonone O		 85.37
C00040054 Populene E
(+)-Populene E		 85.37
C00040055 Populene F
(+)-Populene F		 85.37
C00043103 Versiol
(+)-Versiol		 85.37
C00046123 Mansonone Q
(+)-Mansonone Q		 85.37
C00046829 Mochiquinone 85.37
C00038116 10-Acetoxy-8,9-epoxythymolisobutyrate 83.72
C00038481 Aposphaerin C 83.72
C00049752 Tournefolin A
(-)-Tournefolin A		 83.33
C00001758 Physovenine 82.93
C00002029 Codonopsine 82.93
C00011679 [S-[R*,S*-(E)]]-6-[6-(Acetyloxy)-1,5-dimethyl-4-hexenyl]-3-methyl-2-cyclohexen-1-one 82.93
C00012428 [1S-(1R*,2E,4R*,5R*,6E,10R*)]-3,7,11,11-Tetramethylbicyclo[8.1.0]undeca-2,6-diene-4,5-diol 4-acetate 82.93
C00012524 Deoxyhelicobasidin 82.93
C00019812 Chloculol 82.93
C00019945 Merrillin 82.93
C00019996 Peroxytamarin 82.93
C00020075 5-Hydroxy-8-methoxycalamenene 82.93
C00020078 (1R-trans)-1,2,3,4-Tetrahydro-7-hydroxy-6-methyl-4-(1-methylethyl)-1-naphthalenemethanol 82.93
C00020177 3-Hydroxy-8-calamenenone
(1S,4R)-7-Hydroxycalamenen-3-one		 82.93
C00020231 6-Methoxyprimnatrienone 82.93
C00020771 (E)-O-Methylsuberenol 82.93
C00020772 (1S)-7-Methoxy-1,2-dihydrocadalene 82.93
C00021391 Carotdiol acetate 82.93
C00021655 7-Hydroxy-10-oxodehydrodihydrobotrydial 82.93
C00021656 7,10-Dihydroxydehydrodihydrobotrydial 82.93
C00029304 (+)-Meranzin hydrate 82.93
C00029437 2,7-dihydroxy-11,12-dehydrocalamenene
(-)-2,7-dihydroxy-11,12-dehydrocalamenene		 82.93
C00031505 15-Acetoxy-T-muurolol 82.93
C00033230 Murrangatin
(-)-Murrangatin		 82.93
C00033611 Acetylmajapolene B
(-)-Acetylmajapolene B		 82.93
C00034316 Tiomanene 82.93
C00037240 Heliannuol C
(-)-Heliannuol C		 82.93
C00037493 Meranzin hydrate
(-)-Meranzin hydrate		 82.93
C00037883 Tamarin 82.93
C00038237 3,4-Dihydro-1,2-secomicrominutinin 82.93
C00040050 Populene A
(+)-Populene A		 82.93
C00040051 Populene B
(-)-Populene B		 82.93
C00044408 (6R,7R,8R)-8-Methoxygoniodiol 82.93
C00047558 Schisanwilsonene B
(+)-Schisanwilsonene B		 82.93
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