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


and

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




INPUT WORD = C00010449 , 50% or more
[ Metabolite Name : 2-Bromo-4-chloro-1-(2-chloroethenyl)-1-methyl-5-methylenecyclohexane ]
Number of matched data : 60

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00010454 Plocamene D 96.15
C00010453 Mertensene 92.86
C00010455 Plocamene D'
4-Bromo-2-chloro-(2-chloroethenyl)-1-methyl-5-methylenecyclohexane		 92.31
C00010447 (1R,2R,4S,5R)-2-Bromo-1-(2-bromoethenyl)-4,5,-dichloro-1,5-dimethylcyclohexane 89.29
C00010451 2,4-Dibromo-1-chloro-5-(2-chloroethyenyl)-1,5-dimethylcyclohexane 89.29
C00010452 Gelidene 89.29
C00010382 3-Bromo-8-chloro-6-chloromethyl-2-methyl-1,6-octadiene 88.46
C00010403 4,6-Dibromo-1-chloro-3,7-dimethyl-2,7-octadiene 88.46
C00010450 4-Chloro-5-(2-chloroethyenyl)-1-chloromethyl-5-methylcyclohexane 88.46
C00010464 Plocamene E 88.46
C00010375 Aplysiapyranoid A 85.71
C00010376 Aplysiapyranoid C 85.71
C00010377 Aplysiapyranoid D 85.71
C00010456 Telfairine 85.71
C00010460 4-Bromo-1,5-dichloro-2-chloroethenyl-1,5-dimethylcyclohexane 85.71
C00010463 Plocamene C 85.71
C00010379 7-Bromo-3-bromomethyl-3,6-dichloro-7-methyl-1-octene 85.19
C00010432 Chondrocole A 85.19
C00013224 (-)-Geosmin
Geosmin
[4S-(4alpha,4aalpha,8abeta)]-Octahydro-4,8a-dimethyl-4a(2H)-naphthalenol		 85.19
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		 85.19
C00049147 Dictamnol
(+)-Dictamnol		 85.19
C00001982 beta-Skytanthine 84.62
C00010384 8-Bromo-3,7-dichloro-2,6-dimethyl-1,5-octadiene 84.62
C00010459 Plocamadiene A
2-Bromo-1-chloro-4-(2-chloroethenyl)-1-methyl-5-methylenecyclohexane		 84.62
C00010809 9,10-Cyclo-p-menthane-2,4-diol
[1S-(1alpha,3alpha,4alpha)]-1-Cyclopropyl-4-methyl-1,3-cyclohexsanediol		 84.62
C00011950 5-(1-Methylethyl)-2-propyl-2-cyclohexen-1-one 84.62
C00013220 Cogeijerene
2,3,4,4a,5,6-Hexahydro-1,4a-dimethylnaphthalene		 84.62
C00021846 Norecasantalol 84.62
C00021847 Norecasantalal
eka-Nortricyclosantalal		 84.62
C00021856 exo-Norbicycloekasantalal 84.62
C00023640 Chokol G
3-(3-Hydroxy-2,3-dimethylcyclopentyl)but-3-en-1-ol
(-)-Chokol G		 84.62
C00035468 1-Butyl-2-propylcyclopentane 84.62
C00035475 2,6-Dimethyl-decahydronaphthalene 84.62
C00010457 Violacene 83.33
C00010428 6-Bromo-1,2,8-trichloro-3-ochtodene
4-Bromo-6-chloro-1-(1,2-dichloroethyl)-5,5-dimethylcyclohexene		 82.14
C00010431 2-Chloro-1,6,8-tribromo-3(8)-ochtodene 82.14
C00010438 1,8-Dibromo-2,6-dichloro-3-ochtodene
6-Bromo-1-(2-bromo-1-chloroethyl)-4-chloro-5,5-dimethylcyclohexene		 82.14
C00010461 1,4-Dibromo-5-chloro-2-(2-chloroethenyl)-1,5-dimethylcyclohexane 82.14
C00011518 Chokol A
(-)-Chokol A		 82.14
C00049423 Apakaochtodene A 82.14
C00049424 Apakaochtodene B 82.14
C00001984 Tecostanin 81.48
C00010378 6-Bromo-3-bromomethyl-3,7-dichloro-7-methyl-1-octene 81.48
C00010389 3-Bromomethyl-2,3,6-trichloro-7-methyl-1,6-octadiene 81.48
C00010407 1,6-Dibromo-2,7-dichloro-3,7-dimethyl-1,3-octadiene 81.48
C00010408 4,8-Dibromo-3,7-dichloro-3,7-dimethyl-1,5-octadiene 81.48
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		 81.48
C00017463 (+)-(1S,10R)-1,10-Dimethylbicyclo[4.4.0]dec-6-en-3-one 81.48
C00021926 7-Isopropyl-5-methylbicyclo[2.2.2]oct-5-en-2-one 81.48
C00029545 4-Tridecanone 81.48
C00031881 Incarvilline
(-)-Incarvilline		 81.48
C00035459 11-Methyl-4-dodecanone 81.48
C00035879 n-Tetradecane
Tetradecane		 81.48
C00042177 7-Tetradecene 81.48
C00045569 4,9-Dimethyldecanoic acid 81.48
C00050289 Kinabalurine A
(+)-Kinabalurine A		 81.48
C00050290 Kinabalurine B
(-)-Kinabalurine B		 81.48
C00050292 Kinabalurine D
(-)-Kinabalurine D		 81.48
C00050293 Kinabalurine E
(+)-Kinabalurine E		 81.48
C00050294 Kinabalurine F
(+)-Kinabalurine F		 81.48
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