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


and

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




INPUT WORD = C00010436 , 50% or more
[ Metabolite Name : 1,6-Dibromo-8-chloro-2-ochtoden-4-ol ]
Number of matched data : 89

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00010441 Ochtodene 96.43
C00010432 Chondrocole A 92.86
C00049423 Apakaochtodene A 92.86
C00049424 Apakaochtodene B 92.86
C00010433 Chondrocolactone 89.66
C00010425 (4R,6S,8S)-6-Bromo-1,4-epoxy-2-ochtoden-8-ol
(4alpha,6beta,7aalpha)-(+)-6-bromo-2,4,5,6,7,7a-hexahydro-5,5-dimethyl-4-benzofuranol		 89.29
C00010434 Chondrocole C 89.29
C00010435 1,6-Dibromo-2-chloro-3(8)-ochtoden-4-ol
5-Bromo-2-(2-bromo-1-chloroethl)-4,4-dimethyl-2-cyclohexen-1-ol		 89.29
C00010438 1,8-Dibromo-2,6-dichloro-3-ochtodene
6-Bromo-1-(2-bromo-1-chloroethyl)-4-chloro-5,5-dimethylcyclohexene		 89.29
C00010382 3-Bromo-8-chloro-6-chloromethyl-2-methyl-1,6-octadiene 85.71
C00010439 (1E,4R,6S)-1,6-Dibromo-1,3(8)-ochtodien-4-ol
[1alpha,2(E),5alpha]-(-)-5-bromo-2-(2-bromoethenyl)-4,4-dimethyl-2-cyclohexen-1-ol		 85.71
C00010440 (1E,4S,6S)-1,6-Dibromo-1,3(8)-ochtodien-4-ol
[1alpha,2(E),5beta]-(-)-5-bromo-2-(2-bromoethenyl)-4,4-dimethyl-2-cyclohexen-1-ol		 85.71
C00010406 4,7-Dibromo-3,6-dichloro-3,7-dimethyl-1,2-epoxyoctane 83.33
C00000842 Bornyl acetate 82.76
C00010381 7-Bromo-3-bromomethyl-2,3,6-trichloro-7-methyl-1-octene 82.76
C00029844 Borneol acetate
Bornyl acetate
Bornylacetate		 82.76
C00032377 trans-Pinocarvyl acetate 82.76
C00038113 1,4,8-Tribromo-3,7-dichloro-3,7-dimethyl-1E,5E-octadiene 82.76
C00048136 Speciosin C
(+)-Speciosin C		 82.76
C00000850 Menthyl acetate 82.14
C00010396 (Z)-(-)-8-Chloro-6-chloromethyl-2-methyl-1,6-octadien-3-ol 82.14
C00010403 4,6-Dibromo-1-chloro-3,7-dimethyl-2,7-octadiene 82.14
C00010408 4,8-Dibromo-3,7-dichloro-3,7-dimethyl-1,5-octadiene 82.14
C00010414 3,8-Dichloro-6-chloromethyl-2-methyl-1,6-octadiene 82.14
C00010431 2-Chloro-1,6,8-tribromo-3(8)-ochtodene 82.14
C00010437 (1E,6S,8S)-1,6-Dibromo-8-chloro-1,3-ochtodiene
[1(E),4alpha,6beta]-(+)-4-bromo-1-(2-bromoethenyl)-6-chloro-5,5-dimethylcyclohexene		 82.14
C00010446 Ochtodiol 82.14
C00010447 (1R,2R,4S,5R)-2-Bromo-1-(2-bromoethenyl)-4,5,-dichloro-1,5-dimethylcyclohexane 82.14
C00010451 2,4-Dibromo-1-chloro-5-(2-chloroethyenyl)-1,5-dimethylcyclohexane 82.14
C00010456 Telfairine 82.14
C00010469 trans-Acetate-1-methyl-2-(1-methylethenyl)-cyclobutaneethanol 82.14
C00014978 9-Chloro-8-hydroxy-8,9-deoxyaspyrone 82.14
C00029545 4-Tridecanone 82.14
C00033347 Sachalinol B
(+)-Sachalinol B		 82.14
C00033348 Sachalinol C
(+)-Sachalinol C		 82.14
C00035825 Dihydrocarveol acetate
Dihydrocarveyl acetate
Dihydrocarvyl acetate		 82.14
C00048350 Carvyl acetate 82.14
C00049822 Pantoisofuranoid A
(-)-Pantoisofuranoid A		 82.14
C00049823 Pantoisofuranoid B
(-)-Pantoisofuranoid B		 82.14
C00049824 Pantoisofuranoid C 82.14
C00029325 (3S,5R,6S,9R)-Megastigman-3,9-diol 80.00
C00000847 Isoketocamphoric acid 79.31
C00010380 6-Bromo-3-bromomethyl-2,3,7-trichloro-7-methyl-1-octene 79.31
C00010411 1,8-Dibromo-3,4,7-trichloro-3,7-dimethyl-1,5-octadiene 79.31
C00010417 1,4,6-Tribromo-7-chloro-3,7-dimethyl-1-octen-3-ol 79.31
C00017461 1alpha-Hydroxyisoondetianone 79.31
C00035258 cis-Sabinene hydrate acetate 79.31
C00041581 Halomon
(-)-Halomon		 79.31
C00048669 Curvulide A
(+)-Curvulide A		 79.31
C00000834 1,2-Campholide 78.57
C00000837 2-Hydroxycampholonic acid 78.57
C00001309 Ethyl (E,Z)-decadienoate 78.57
C00010375 Aplysiapyranoid A 78.57
C00010378 6-Bromo-3-bromomethyl-3,7-dichloro-7-methyl-1-octene 78.57
C00010379 7-Bromo-3-bromomethyl-3,6-dichloro-7-methyl-1-octene 78.57
C00010383 2-(Bromochloromethyl)-1,5,6-trichloro-6-methyl-1,3,7-octatriene 78.57
C00010398 8-Chloro-6-chloromethyl-2-methyl-2,6-octadien-1-ol 78.57
C00010426 (2R,4R,6S)-6-Bromo-1,4-epoxy-3(8)-ochtoden-2-ol
(3alpha,6beta,7aalpha)-(-)-6-bromo-2,3,5,6,7,7a-hexahydro-5,5-dimethyl-3-benzofuranol		 78.57
C00010427 (2S,4R,6S)-6-Bromo-1,4-epoxy-3(8)-ochtoden-2-ol
(3alpha,6alpha,7abeta)-(-)-6-bromo-2,3,5,6,7,7a-hexahydro-5,5-dimethyl-3-benzofuranol		 78.57
C00010428 6-Bromo-1,2,8-trichloro-3-ochtodene
4-Bromo-6-chloro-1-(1,2-dichloroethyl)-5,5-dimethylcyclohexene		 78.57
C00010452 Gelidene 78.57
C00010453 Mertensene 78.57
C00010454 Plocamene D 78.57
C00010459 Plocamadiene A
2-Bromo-1-chloro-4-(2-chloroethenyl)-1-methyl-5-methylenecyclohexane		 78.57
C00010460 4-Bromo-1,5-dichloro-2-chloroethenyl-1,5-dimethylcyclohexane 78.57
C00010461 1,4-Dibromo-5-chloro-2-(2-chloroethenyl)-1,5-dimethylcyclohexane 78.57
C00010463 Plocamene C 78.57
C00010897 [1S-(1a,2a,4b)]-1-methyl-4-(1-methylethyl)-1,2,4-Cyclohexanetriol 78.57
C00011518 Chokol A
(-)-Chokol A		 78.57
C00012026 Geijeron
Geijerone		 78.57
C00013224 (-)-Geosmin
Geosmin
[4S-(4alpha,4aalpha,8abeta)]-Octahydro-4,8a-dimethyl-4a(2H)-naphthalenol		 78.57
C00013225 (4aS-trans)-4,4a,5,6,7,8-hexahydro-4a,8-dimethyl-2(3H)-Naphthalenone
(+)-(6S,10S)-6,10-Dimethylbicyclo[4.4.0]dec-1-en-3-one
(+)-(S,S)-6,10-Dimethylbicyclo[4.4.0]dec-1-en-3-one		 78.57
C00025551 3alpha-Acetoxytropane

Acetyltropine
O-Acetyltropine
Tropan-3a-ol acetate (ester)
Tropine acetate (ester)
Tropyl acetate
endo-3-Acetoxy-8-methyl-8-azabicyclo[3.2.1]octane		 78.57
C00025556 3beta-Acetoxytropane
O-Acetylpseudotropine		 78.57
C00030347 gamma-Dodecalactone 78.57
C00031881 Incarvilline
(-)-Incarvilline		 78.57
C00035459 11-Methyl-4-dodecanone 78.57
C00035536 beta-Damascenone
(E)-beta-Damascenone		 78.57
C00035548 Butyl caprylate 78.57
C00035611 Ethyl decanoate
Ethyl caprate		 78.57
C00036900 Chrysanthemyl acetate 78.57
C00039778 Modiolide A
(+)-Modiolide A		 78.57
C00040379 Stagonolide E
(-)-Stagonolide E		 78.57
C00048560 Tridecanal 78.57
C00050289 Kinabalurine A
(+)-Kinabalurine A		 78.57
C00050290 Kinabalurine B
(-)-Kinabalurine B		 78.57
C00050292 Kinabalurine D
(-)-Kinabalurine D		 78.57
C00050293 Kinabalurine E
(+)-Kinabalurine E		 78.57
C00050294 Kinabalurine F
(+)-Kinabalurine F		 78.57
Page Top