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


and

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




INPUT WORD = C00010377 , 50% or more
[ Metabolite Name : Aplysiapyranoid D ]
Number of matched data : 70

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00010376 Aplysiapyranoid C 100.00
C00010375 Aplysiapyranoid A 96.43
C00010451 2,4-Dibromo-1-chloro-5-(2-chloroethyenyl)-1,5-dimethylcyclohexane 92.86
C00010452 Gelidene 92.86
C00010460 4-Bromo-1,5-dichloro-2-chloroethenyl-1,5-dimethylcyclohexane 92.86
C00010448 4-Bromo-5-bromomethyl-2,5-dichloro-1-chloroethenyl-1-methylcyclohexane 90.00
C00010447 (1R,2R,4S,5R)-2-Bromo-1-(2-bromoethenyl)-4,5,-dichloro-1,5-dimethylcyclohexane 89.29
C00010453 Mertensene 89.29
C00010455 Plocamene D'
4-Bromo-2-chloro-(2-chloroethenyl)-1-methyl-5-methylenecyclohexane		 89.29
C00010456 Telfairine 89.29
C00010461 1,4-Dibromo-5-chloro-2-(2-chloroethenyl)-1,5-dimethylcyclohexane 89.29
C00010457 Violacene 86.67
C00011510 Kumepaloxane 86.67
C00049826 Pantopyranoid B
(-)-Pantopyranoid B		 86.67
C00049827 Pantopyranoid C
(-)-Pantopyranoid C		 86.67
C00010391 8-Bromo-1,3,4,7-tetrachloro-3,7-dimethyl-1,5-octadiene 86.21
C00010417 1,4,6-Tribromo-7-chloro-3,7-dimethyl-1-octen-3-ol 86.21
C00010379 7-Bromo-3-bromomethyl-3,6-dichloro-7-methyl-1-octene 85.71
C00010449 2-Bromo-4-chloro-1-(2-chloroethenyl)-1-methyl-5-methylenecyclohexane 85.71
C00010454 Plocamene D 85.71
C00010459 Plocamadiene A
2-Bromo-1-chloro-4-(2-chloroethenyl)-1-methyl-5-methylenecyclohexane		 85.71
C00010463 Plocamene C 85.71
C00011518 Chokol A
(-)-Chokol A		 85.71
C00035459 11-Methyl-4-dodecanone 85.71
C00049423 Apakaochtodene A 85.71
C00049424 Apakaochtodene B 85.71
C00049822 Pantoisofuranoid A
(-)-Pantoisofuranoid A		 85.71
C00049823 Pantoisofuranoid B
(-)-Pantoisofuranoid B		 85.71
C00049824 Pantoisofuranoid C 85.71
C00010326 3-Acetoxy-2,2,6-trimethyl-6-vinyltetrahydropyran
2,2,6-Trimethyl-2-vinyl-5-acetoxytetrahydropyran		 83.33
C00010406 4,7-Dibromo-3,6-dichloro-3,7-dimethyl-1,2-epoxyoctane 83.33
C00049825 Pantopyranoid A
(-)-Pantopyranoid A		 83.33
C00010411 1,8-Dibromo-3,4,7-trichloro-3,7-dimethyl-1,5-octadiene 82.76
C00013221 Cybullol
2,[2S-(2alpha,4aalpha,5alpha,8abeta)]-Octahydro-5,8a-dimethyl-4a(2H)-naphthalenediol		 82.76
C00022685 6-Hydroxy-7(9)-dehydro-6,7-dihydrogeranyl acetate 82.76
C00022687 6-Oxo-7(9)-dehydro-6,7-dihydrogeranyl acetate 82.76
C00022689 6-Hydroxy-7(9)-dehydro-6,7-dihydroneryl acetate 82.76
C00030882 2-Octyl 3-methyl butyrate
Octyl isovalerate		 82.76
C00041581 Halomon
(-)-Halomon		 82.76
C00001221 Lauric acid
Docosanoic acid
n-Dodecanoic acid
Dodecanoic acid		 82.14
C00003046 Geranyl acetate
Acetic acid geraniol ester
trans-Geranyl acetate		 82.14
C00010325 Epoxylinalool
Linalool oxide
3-Hydroxy-2,2,6-trimethyl-6-vinyltetrahydropyran		 82.14
C00010327 3-Oxo-2,2,6-trimethyl-6-vinyltetrahydropyran
2,6,6-Trimethyl-2-vinyl-5-ketotetrahydropyran		 82.14
C00010378 6-Bromo-3-bromomethyl-3,7-dichloro-7-methyl-1-octene 82.14
C00010382 3-Bromo-8-chloro-6-chloromethyl-2-methyl-1,6-octadiene 82.14
C00010388 3-Bromomethyl-2,3-dichloro-7-methyl-1,6-octadiene 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
C00010446 Ochtodiol 82.14
C00010464 Plocamene E 82.14
C00010829 1,4-Epoxy-p-menthane-2,3-diol
Ascaridole glycol		 82.14
C00010897 [1S-(1a,2a,4b)]-1-methyl-4-(1-methylethyl)-1,2,4-Cyclohexanetriol 82.14
C00011495 Nordavanone 82.14
C00012026 Geijeron
Geijerone		 82.14
C00021848 Nortricycloekasantalic acid
eka-Nortricyclosantalic acid		 82.14
C00023640 Chokol G
3-(3-Hydroxy-2,3-dimethylcyclopentyl)but-3-en-1-ol
(-)-Chokol G		 82.14
C00029590 7-Methoxy-3,7-dimethyl-octanal 82.14
C00029816 beta-Ionone
(E)-beta-Ionone
beta-lonone
trans-beta-ionone		 82.14
C00030347 gamma-Dodecalactone 82.14
C00034747 cis-Linalool oxide pyranoid
Z-Pyranoid linalool oxide		 82.14
C00035138 Neryl acetate 82.14
C00035371 Plocoralide B 82.14
C00035472 2,2,6-Trimethyldecane 82.14
C00035536 beta-Damascenone
(E)-beta-Damascenone		 82.14
C00035564 Citronellyl acetate
Citronellol acetate		 82.14
C00036263 2-Tridecanone 82.14
C00036314 (+)-Menthyl acetate 82.14
C00037428 Longifone
(+)-Longifone		 82.14
C00045569 4,9-Dimethyldecanoic acid 82.14
C00049147 Dictamnol
(+)-Dictamnol		 82.14
Page Top