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


and

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





INPUT WORD = C00012771 , 50% or more
[ Metabolite Name : Pterocarptriol , [1R-(1alpha,3alpha,4abeta,7beta,8aalpha)]-Decahydro-7-(1-hydroxy-1-methylethyl)-1,4a-dimethyl-1,3-naphthalenediol ]
Number of matched data : 63

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012772 Pterocarpdiolone
[4R-(4alpha,4aalpha,6beta,8abeta)]-Octahydro-4-hydroxy-6-(1-hydroxy-1-methylethyl)-4,8a-dimethyl-2(1H)-naphthalenone
100.00
C00012773 Pigmol
Pygmol
[1R-(1alpha,4abeta,7beta,8alpha,8aalpha)]-Decahydro-7-(1-hydroxy-1-methylethyl)-1,4a-dimethyl-1,8-naphthalenediol
97.30
C00012765 Cryptomeridiol
Proximadiol
Selina-4,7-diol
Selinane-4alpha,11-diol
94.59
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
94.59
C00013101 [1aR-(1aalpha,3abeta,6beta,8abeta,8balpha)]-Octahydro-3a,7,7,8b-tetramethyl-2H-6,8a-methanooxireno[i][1]benzoxepin 94.59
C00013102 [1aS-(1aalpha,3aalpha,6alpha,8aalpha,8balpha)]-Octahydro-3a,7,7,8b-tetramethyl-2H-6,8a-methanooxireno[i][1]benzoxepin 94.59
C00013104 4-Hydroxydihydroagarofuran
[3R-(3alpha,5aalpha,9alpha,9aalpha)]-Octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-9-ol
94.59
C00030062 Curcarabranol A 94.59
C00030063 Curcarabranol B
(+)-Curcarabranol B
94.59
C00035496 4,5-epi-Cryptomeridiol 94.59
C00003213 (+)-Arbusculin A
Arbusculin A
[3aS-(3aalpha,5abeta,9alpha,9aalpha,9bbeta)]-Decahydro-9-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
92.11
C00012787 alpha-Epoxykudtdiol
[1R-[1alpha,4abeta,7beta(R*),8aalpha]]-2-(Octahydro-4a-methylspiro[naphthalene-1(2H),2'-oxiran]-7-yl)-1,2-propanediol
92.11
C00013055 11,13-Dihydroarbusculin A
Colartin
[3S-(3alpha,3aalpha,5abeta,9alpha,9aalpha,9bbeta)]-Decahydro-9-hydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one
92.11
C00013203 Desacetylphytuberin
Phytuberol
Deacetylphytuberin
[3aR-(3aalpha,5abeta,8beta,9alphaR*)]- 5,5a,6,7,8,9-Hexahydro-alpha,alpha,3a,5a-tetramethyl-3aH-furo[3,2-c]isobenzofuran-8-methanol
92.11
C00020421 Kessoglycol
3beta,6alpha-Dihydroxykessane
92.11
C00023999 Isosativenetriol 92.11
C00011434 Caparrapitriol 91.89
C00011463 [2R-[2alpha(2R*,4E),5beta]]-2-(5-Ethenyltetrahydro-5-methyl-2-furanyl)-6-hydroxy-6-methyl-4-hepten-3-one 91.89
C00011529 Cyclonerodiol oxide 91.89
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 91.89
C00012764 Ajanol
[1S-(1alpha,4aalpha,7alpha,8beta,8abeta)]-Decahydro-1,4a-dimethyl-7-(1-methylethyl)-1,8-naphthalenediol
91.89
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
91.89
C00012785 Arctiol
[2S-(2alpha,3beta,4aalpha,8abeta)]-Decahydro-3-hydroxy-alpha,alpha,4a-trimethyl-8-methylene-2-naphthalenemethanol
91.89
C00012796 Chenopotriol
[1R-(1alpha,2beta,4abeta,7alpha,8aalpha)]-Decahydro-2-(1-hydroxy-1-methylethyl)-4a-methyl-8-methylene-1,7-naphthalenediol
91.89
C00012797 [1R-(1alpha,2beta,4abeta,7beta,8aalpha)]-Decahydro-2-(1-hydroxy-1-methylethyl)-4a-methyl-8-methylene-1,7-naphthalenediol
3-epi-Chenopotriol
91.89
C00012798 Longilobol
(2alpha,3beta,4aalpha,8abeta)-(+)-Octahydro-3-(1-hydroxy-1-methylethyl)-8a-methyl-5-methylene-2,4a(2H)-naphthalenediol
91.89
C00013556 (+)-Bullatantriol
Bullatantriol
(1R,3aR,4R,7S,7aR)-Octahydro-1-(2-hydroxy-2-methylpropyl)-3a,7-dimethyl-1H-indene-4,7-diol
91.89
C00016997 Lateriflorol 91.89
C00020060 Isokhusinoloxide 91.89
C00020422 alpha-Kessyl alcohol 91.89
C00021575 Cyclodehydroisolubimin 91.89
C00022681 11-Hydroxy-4,5-seco-eudesmane-4,5-dione 91.89
C00030609 Kikkanol A
(+)-Kikkanol A
91.89
C00031162 Rhombitriol
(-)-Rhombitriol
91.89
C00031907 Isokhusinodiol
(-)-Isokhusinodiol
91.89
C00036906 CID is old! 91.89
C00037925 trans,trans-Xanthoxin 91.89
C00043343 Canusesnol D
(+)-Canusesnol D
91.89
C00048255 1beta,4beta,6beta-Trihydroxyeudesmane 91.89
C00013187 (-)-Isocelorbicol
Isocelorbicol
[3R-(3alpha,5beta,5aalpha,6alpha,7alpha,9alpha,9aalpha)]-Octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5,6,7-triol
90.00
C00012769 Chenopotetraol
[1S-(1alpha,2alpha,4abeta,7beta,8alpha,8aalpha)]-Decahydro-7-(1-hydroxy-1-methylethyl)-1,4a-dimethyl-1,2,8-naphthalenetriol
89.74
C00012770 [1S-(1alpha,2beta,4abeta,7beta,8alpha,8aalpha)]-Decahydro-7-(1-hydroxy-1-methylethyl)-1,4a-dimethyl-1,2,8-naphthalenetriol 89.74
C00003310 Ivalin
[3aR-(3aalpha,4aalpha,7alpha,8abeta,9aalpha)]-Decahydro-7-hydroxy-8a-methyl-3,5-bis(methylene)-naphtho[2,3-b]furan-2(3H)-one
89.47
C00012704 6alpha,15alpha-Epoxy-1beta,4beta-dihydroxyeudesmane
[2aS-(2aalpha,5alpha,5aalpha,8alpha,8aalpha,8bbeta)]-Octahydro-5a-methyl-8-(1-methylethyl)-2H-naphtho[1,8-bc]furan-2a,5(3H)-diol
89.47
C00012895 2alpha-Hydroxy alantolactone 89.47
C00012896 2-Oxoalantolactone
[3aR-(3aalpha,5beta,8abeta,9aalpha)]-3,3a,5,6,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2,7-dione
89.47
C00012914 Septuplinolide
[3aR-(3aalpha,4aalpha,5beta,8abeta,9aalpha)]-Decahydro-5-hydroxy-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one
89.47
C00012916 Telekin
Telekine
[3aR-(3aalpha,4aalpha,8abeta,9aalpha)]-Decahydro-4a-hydroxy-8a-methyl-3,5-bis(methylene)-naphtho[2,3-b]furan-2(3H)-one
89.47
C00012918 5-Epitelekin
[3aR-(3aalpha,4abeta,8abeta,9aalpha)]-Decahydro-4a-hydroxy-8a-methyl-3,5-bis(methylene)-naphtho[2,3-b]furan-2(3H)-one
89.47
C00020094 5,8-Epoxy-4-hydroxy-3-amorphanone 89.47
C00020100 Gmelofuran
Hibiscone C
89.47
C00020712 Periplanone B 89.47
C00021612 4-Chloro-3,7-epoxy-9-chamigranone 89.47
C00021696 Asperilin 89.47
C00023730 Arthrosporone 89.47
C00023731 Arthrosporol 89.47
C00033303 Pipelol A
(-)-Pipelol A
89.47
C00037585 Orientalol E
(+)-Orientalol E
89.47
C00039345 Hebelodendrol
(-)-Hebelodendrol
89.47
C00045553 3,4-Epoxy-11alpha,13-dihydroelemen-12,8-olide
(+)-3,4-Epoxy-11alpha,13-dihydroelemen-12,8-olide
89.47
C00045554 3,4-Epoxy-5,10-epi-elemasteriractinolide 89.47
C00045919 Epoxyjaeschkeanadiol
Jaeschkeanadiol alpha-epoxide
89.47
C00046478 Tubipolide D
(-)-Tubipolide D
89.47
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