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


and

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




INPUT WORD = C00012855 , 50% or more
[ Metabolite Name : Isopterocarpolone , [4aR-(4aalpha,6beta,8abeta)]-4a,5,6,7,8,8a-Hexahydro-6-(1-hydroxy-1-methylethyl)-4,8a-dimethyl-2(1H)-naphthalenone ]
Number of matched data : 54

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012777 alpha-Chenopodiol
[1R-(1alpha,2beta,4abeta,8aalpha)]-1,2,3,4,4a,5,6,8a-octahydro-1-hydroxy-alpha,alpha,4a,8-tetramethyl-2-naphthalenemethanol		 97.14
C00012843 Chenopodienolone
(6R-cis)-6,7,8,8a-Tetrahydro-6-(1-hydroxy-1-methylethyl)-4,8a-dimethyl-2(1H)-naphthalenone		 97.14
C00040945 Dictyophorin B 97.14
C00012698 [4aR-(4aalpha,5alpha,6beta,8abeta)]-4a,5,6,7,8,8a-Hexahydro-5-hydroxy-6-(1-hydroxy-1-methylethyl)-4,8a-dimethyl-2(1H)-naphthalenone 94.59
C00038316 7alpha-Hydroxyisopterocarpolone 94.59
C00040944 Dictyophorin A 94.44
C00012048 Occidiol
Occidenol		 94.29
C00012756 [4aR-(4aalpha,6beta,8aalpha)]-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone 94.29
C00012757 [4aS-(4aalpha,6alpha,8abeta)]-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone 94.29
C00012758 [4aS-(4aalpha,6alpha,8aalpha)]-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone 94.29
C00012782 (+)-Pterocarpol
Eudesm-4(14)-ene-2a,11-diol
[2R-(2alpha,4aalpha,6beta,8abeta)]-decahydro-6-hydroxy-alpha,alpha,4a-trimethyl-8-methylene-2-naphthalenemethanol		 94.29
C00012803 7-epi-alpha-Eudesmol
[2S-(2alpha,4abeta,8aalpha)]-1,2,3,4,4a,5,6,8a-Octahydro-alpha,alpha,4a,8-tetramethyl-2-naphthalenemethanol		 94.29
C00012841 alpha-Rotunol
[4aS-(4aalpha,6beta,8abeta)]-4a,5,6,7,8,8a-hexahydro-4a-hydroxy-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone		 94.29
C00012842 (+)-beta-Rotunol
beta-Rotunol
[4aR-(4aalpha,6alpha,8aalpha)]-4a,5,6,7,8,8a-hexahydro-4a-hydroxy-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone		 94.29
C00049948 3-Hydroxysolavetivone
(+)-3-Hydroxysolavetivone		 94.29
C00021613 2-Chloro-3-hydroxy-7-chamigren-9-one 91.89
C00012879 (+)-Isoalloalantolactone
Isoalloalantolactone
[3aR-(3aalpha,4aalpha,8abeta,9aalpha)]-3a,4,4a,7,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one		 91.67
C00012880 Diplophyllolide A
[3aS-(3aalpha,4aalpha,8abeta,9aalpha)]-3a,4,4a,7,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one		 91.67
C00021320 10-Hydroxy-3-longipinen-5-one 91.67
C00000163 alpha-Eudesmol 91.43
C00012000 8alpha,11-Elemadiol 91.43
C00012719 [2R-(2alpha,4aalpha,5beta,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-5-hydroxy-4a,8-dimethyl-b-methylene-2-naphthaleneethanol
Cnicothamnol		 91.43
C00012720 Cnicothamnal
[2R-(2alpha,4aalpha,5beta,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-5-hydroxy-4a,8-dimethyl-a-methylene-2-naphthaleneacetaldehyde		 91.43
C00012736 Ent-8beta-hydroxyeudesma-3,11-diene
[2S-(2alpha,3alpha,4abeta,8aalpha)]-1,2,3,4,4a,7,8,8a-Octahydro-5,8a,dimethyl-3-(1-methylethenyl)-2-naphthalenol		 91.43
C00012765 Cryptomeridiol
Proximadiol
Selina-4,7-diol
Selinane-4alpha,11-diol		 91.43
C00012783 beta-Chenopodiol
4(14)-Eudesmene-6a,11-diol
[1R-(1alpha,2beta,4abeta,8aalpha)]-Decahydro-1-hydroxy-alpha,alpha,4a-trimethyl-8-methylene-2-naphthalenemethanol		 91.43
C00012785 Arctiol
[2S-(2alpha,3beta,4aalpha,8abeta)]-Decahydro-3-hydroxy-alpha,alpha,4a-trimethyl-8-methylene-2-naphthalenemethanol		 91.43
C00012801 alpha-Verbesinol
[1R-(1alph,2alpha,4aalpha,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-2-(1-methylethyl)-1-naphthalenol		 91.43
C00012802 Isoacolamone
[2S-(2alpha,4aalpha,8abeta)]-3,4,4a,5,6,8a-Hexahydro-4a,8-dimethyl-2-(1-methylethyl)-1(2H)-naphthalenone		 91.43
C00013100 Dehydrodeoxybaimuxinol
alpha-Agarofuran		 91.43
C00013105 beta-Agarofuran
[3R-(3alpha,5aalpha,9aalpha)]-Octahydro-2,2,5a-trimethyl-9-methylene-2H-3,9a-methano-1-benzoxepin		 91.43
C00021325 Vulgarone B 91.43
C00021870 Mustakone 91.43
C00033700 Carissone
(+)-Carissone		 91.43
C00035496 4,5-epi-Cryptomeridiol 91.43
C00037349 Itomanol
(-)-Itomanol		 91.43
C00038047 (-)-7-epi-Isojunenol 91.43
C00043618 Isolemnalol
(-)-Isolemnalol		 91.43
C00045807 Cubebenone
(+)-Cubebenone		 91.43
C00047877 Fetidone B
(+)-Fetidone B		 91.43
C00049098 7-epi-beta-Eudesmol 91.43
C00043342 Canusesnol C
(+)-Canusesnol C		 89.74
C00012912 Pinnatifidin (Helenium)
[3aR-(3aalpha,4aalpha,8abeta,9aalpha)]-3,3a,4,4a,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenepinnatifidin
Naphtho[2,3-b]furan-2,7-dione		 89.47
C00012695 (+)-alpha-Carissanol
alpha-Carissanol
[3R-(3alpha,4abeta,7beta)]-4,4a,5,6,7,8-hexahydro-3-hydroxy-7-(1-hydroxy-1-methylethyl)-1,4a-dimethyl-2(3H)-Naphthalenone		 89.19
C00012771 Pterocarptriol
[1R-(1alpha,3alpha,4abeta,7beta,8aalpha)]-Decahydro-7-(1-hydroxy-1-methylethyl)-1,4a-dimethyl-1,3-naphthalenediol		 89.19
C00012772 Pterocarpdiolone
[4R-(4alpha,4aalpha,6beta,8abeta)]-Octahydro-4-hydroxy-6-(1-hydroxy-1-methylethyl)-4,8a-dimethyl-2(1H)-naphthalenone		 89.19
C00012834 [2R-(2alpha,4aalpha,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-alpha-methylene-6-oxo-2-naphthaleneacetic acid 89.19
C00021603 Laurencenone A 89.19
C00043343 Canusesnol D
(+)-Canusesnol D		 89.19
C00003241 alpha-Cyclocostunolide 88.89
C00012900 Isoalantodiene
[3aR-(3aalpha,8abeta,9aalpha)]-3a,7,8,8a,9,9a-Hexahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one		 88.89
C00013036 Gazaniolide
[3aS-(3aalpha,5abeta,9aalpha,9bbeta)]-3a,4,5,5a,9a,9b-Hexahydro-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 88.89
C00013104 4-Hydroxydihydroagarofuran
[3R-(3alpha,5aalpha,9alpha,9aalpha)]-Octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-9-ol		 88.89
C00020422 alpha-Kessyl alcohol 88.89
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