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


and

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




INPUT WORD = C00020185 , 50% or more
[ Metabolite Name : (1S,4S)-7-Methoxycalamenen-3-one ]
Number of matched data : 76

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00020773 (1S,4R)-7-Methoxycalamenen-4-ol 100.00
C00020075 5-Hydroxy-8-methoxycalamenene 94.59
C00020175 3-Methoxy-8-calamenenol
(1S,3R,4R)-7-Methoxycalamenen-3-ol		 94.59
C00020179 3-Methoxy-8-calamenenone
(1S,4R)-7-Methoxycalamenen-3-one		 94.59
C00020180 (1S,3R,4R)-Calamenene-3,4,7-triol 94.59
C00020774 (1S,3R,4S)-Calamenene-3,4,7-triol 94.59
C00020080 3-Methoxy-14-calamenoic acid 92.31
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
C00020772 (1S)-7-Methoxy-1,2-dihydrocadalene 91.89
C00029437 2,7-dihydroxy-11,12-dehydrocalamenene
(-)-2,7-dihydroxy-11,12-dehydrocalamenene		 91.89
C00037239 Heliannuol A
(-)-Heliannuol A		 91.89
C00037241 Heliannuol D
(+)-Heliannuol D		 91.89
C00049723 Heliannuol K
(+)-Heliannuol K		 91.89
C00030728 Mansonone N
(+)-Mansonone N		 90.24
C00020232 3-Hydroxy-6-methoxyprimnatrienone 89.74
C00030729 Mansonone O
(-)-Mansonone O		 89.74
C00046123 Mansonone Q
(+)-Mansonone Q		 89.74
C00037249 Helibisabonol A
(-)-Helibisabonol A		 89.47
C00037250 Helibisabonol B 89.47
C00045887 Enokipodin A
(+)-Enokipodin A		 89.47
C00012524 Deoxyhelicobasidin 89.19
C00020069 3-Hydroxy-beta-calacorene 89.19
C00020174 (1S,3R,4S)-Calamenene-3,7-diol 89.19
C00020200 3-Methoxy-14-norcalamenene 89.19
C00020202 3-Methoxy-14-nor-10-calamenenone 89.19
C00020231 6-Methoxyprimnatrienone 89.19
C00037240 Heliannuol C
(-)-Heliannuol C		 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
C00043340 Canusesnol A
(-)-Canusesnol A		 89.19
C00045888 Enokipodin B
(-)-Enokipodin B		 89.19
C00046557 12-Hydroxydehydrobotrydienol
(+)-12-Hydroxydehydrobotrydienol		 89.19
C00020131 3-Acetoxy-2-hydroxycalamenene 87.80
C00020178 3-Acetoxy-8-calamenenone
(1S,4R)-7-Acetoxycalamenen-3-one		 87.80
C00003158 Lacinilene C 7-methyl ether 87.18
C00020234 6-Methoxy-1,3-primnatrienedione 87.18
C00037243 Heliannuol F
(+)-Heliannuol F		 87.18
C00040054 Populene E
(+)-Populene E		 87.18
C00040055 Populene F
(+)-Populene F		 87.18
C00011686 O-Methylperezone
(-)-2-(1,5-Dimethyl-4-hexenyl)-3-methoxy-5-methyl-p-benzoquinone		 86.84
C00012561 (2alpha,5beta,10S*)-(-)-7-bromo-4,5-dihydro-5,8,10-trimethyl-2,5-methano-1-benzoxepin-2(3H)-methanol
Filiforminol		 86.84
C00020158 Ryomenin 86.84
C00041270 3beta-Hydroxyaplysin
(-)-3beta-Hydroxyaplysin		 86.84
C00049249 Parahigginic acid
(-)-Parahigginic acid		 86.84
C00002742 Fagaramide 86.49
C00011900 (+/-)-ar-Todomatuic acid
ar-Todomatuic acid
(R)-4-(1,5-Dimethyl-3-oxohexyl)benzoic acid		 86.49
C00012511 (-)-delta-Cuparenol
(S)-2-Hydroxycuparene
delta-Cuparenol
Cuparophenol
(S)-2-Methyl-5-(1,2,2-trimethylcyclopentyl)phenol		 86.49
C00012512 2,3-Dihydroxycuparene
(S)-3-Methyl-6-(1,2,2-trimethylcyclopentyl)-1,2-benzenediol		 86.49
C00012514 alpha-Isocuparenol 86.49
C00012515 alpha-Cuparenol 86.49
C00012533 Cuparenic acid 86.49
C00012540 [1S-(1alpha,2beta,5alpha)]-2-(1,2-Dimethylbicyclo[3.1.0]hex-2-yl)-5-methyl-2,5-cyclohexadiene-1,4-dione
(-)-Laurequinone
Laurequinone		 86.49
C00012544 (S)-4-Hydroxy-3-(1,2,2-trimethylcyclopentyl)benzaldehyde
(-)-alpha-Formylherbertenol		 86.49
C00012545 (-)-Herbertenediol
Herbertenediol(S)-5-Methyl-3-(1,2,2-trimethylcyclopentyl)-1,2-benzenediol		 86.49
C00012551 [3S-(3alpha,3abeta,8bbeta)]-7-Bromo-2,3,3a,8b-tetrahydro-3,3a,6,8b-tetramethyl-1H-cyclopenta[b]benzofuran
Aplysin (7CI)
(-)-Aplysin
Aplysin		 86.49
C00012560 [2S-(2alpha,5alpha,10S*)]-7-Bromo-2,3,4,5-tetrahydro-2,5,8,10-tetramethyl-2,5-methano-1-benzoxepin
(-)-Filiformin
Filiformin		 86.49
C00012563 [2S-(2alpha,5beta,10S*)]-7-Bromo-2,3,4,5-tetrahydro-2-(iodomethyl)-5,8,10-trimethyl-2,5-methano-1-benzoxepin
Iodoether A		 86.49
C00012564 (+)-2-(Bromomethyl)-2,3,4,5-tetrahydro-5,8,10-trimethyl-2,5-methano-1-benzoxepin 86.49
C00020068 3-Hydroxy-alpha-calacorene 86.49
C00020073 5-Hydroxycalamenene 86.49
C00020168 3,5-Dihydro-8-hydroxy-5-isopropyl-2,7-dimethyl-1-benzoxepin-4(2H)-one 86.49
C00020177 3-Hydroxy-8-calamenenone
(1S,4R)-7-Hydroxycalamenen-3-one		 86.49
C00020427 Pechueloic acid 86.49
C00034980 (-)-7-Hydroxycalamenene 86.49
C00035991 (-)-Herbertene-1,12-diol 86.49
C00036014 4'-Methoxycinnamyl isovalerate 86.49
C00037242 Heliannuol E
(-)-Heliannuol E		 86.49
C00037244 Heliannuol G
(-)-Heliannuol G		 86.49
C00037245 Heliannuol H
(-)-Heliannuol H		 86.49
C00042434 Cyclolauren-2-ol
(+)-Cyclolauren-2-ol		 86.49
C00042680 Laur-11-en-1,10-diol
(-)-Laur-11-en-1,10-diol		 86.49
C00049011 Schiffnerone A
(+)-Schiffnerone A		 86.49
C00049250 Parahigginol A
(-)-Parahigginol A		 86.49
C00049253 Parahigginol D
(-)-Parahigginol D		 86.49
Page Top