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


and

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




INPUT WORD = C00012699 , 50% or more
[ Metabolite Name : [4aR-(4aalpha,5alpha,6beta,8abeta)]-5-(Acetyloxy)-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 (%)
C00012924 [3aR-(3aalpha,4aalpha,8abeta,9aalpha)]- 5-[(Acetyloxy)methyl]-3a,4,4a,7,8,8a,9,9a-octahydro-8a-methyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one
15-Acetoxyisoalloalantolactone		 90.91
C00012070 Shiromodiol monoacetate 90.70
C00012735 [1S-(1alpha,2beta,4abeta,8aalpha)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-2-(1-methylethenyl)-1-naphthalenol acetate 90.70
C00012784 [1R-(1alpha,2beta,4abeta,8aalpha)]-1-(Acetyloxy)decahydro-alpha,alpha,4a-trimethyl-8-methylene-2-naphthalenemethanol 90.70
C00020946 6-Acetylferulidin 89.13
C00003172 (-)-Phytuberin
Phytuberin
(3aR,5aS,8R,9aR)-5,5a,6,7,8,9-Hexahydro-a,a,3a,5a-tetramethyl-3aH-furo[3,2-c]isobenzofuran-8-methanol acetate		 88.64
C00013053 1alpha-Acetoxy-11beta(H),13-dihydrodouglanin
[3S-(3alpha,3aalpha,5abeta,6alpha,9aalpha,9bbeta)]-6-(Acetyloxy)-3a,4,5,5a,6,7,9a,9b-octahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one		 88.64
C00021695 Acetylivalin 88.64
C00003379 epi-Tulipinolide 88.37
C00011432 [3R-(3R*,5S*,6E,9S*)]-3,7,11-trimethyl-1,6,10-dodecatriene-3,5,9-triol 9-acetate 88.37
C00011703 Tanacetol B 88.37
C00011704 (-)-Tanacetol A
Tanacetol A		 88.37
C00012037 Epitulipdienolide
Elemanolide		 88.37
C00012686 Austradiol acetate
[1R-(1a,4beta,4abeta,7alpha,8alpha,8aalpha)]-4-Bromodecahydro-1,4a-dimethyl-7-(1-methylethyl)-1,8-naphthalenediol 8-acetate		 88.37
C00012774 [1R-(1alpha,4abeta,7beta,8alpha,8aalpha)]-Decahydro-7-(1-hydroxy-1-methylethyl)-1,4a-dimethyl-1,8-naphthalenediol 1-acetate 88.37
C00015381 5,6-Dihydrocineromycin B 88.37
C00016030 7-O-demethyl-albocycline
Cineromycin B		 88.37
C00016219 7-Demethoxy-7-oxo-albocycline
Dehydrocineromycin B		 88.37
C00016221 7-O-Demethyl-2,3-dihydro-albocycline
2,3-Dihydrocineromycin B		 88.37
C00020355 6beta-Acetoxy-1beta-hydroxy-4,11-guaiadien-3-one 88.37
C00021263 Plagiochiline H 88.37
C00042880 Pulicanadienal B
(+)-Pulicanadienal B		 88.37
C00045183 4alpha-Hydroxy-5beta-acetoxy-epi-cubenol
(+)-4alpha-Hydroxy-5beta-acetoxy-epi-cubenol		 88.37
C00047558 Schisanwilsonene B
(+)-Schisanwilsonene B		 88.37
C00012972 Isoludalbin
[3aR-(3aalpha,4alpha,5abeta,6alpha,9aalpha,9bbeta)]-6-(acetyloxy)-3a,4,5,5a,6,7,9a,9b-Octahydro-4-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 86.96
C00030866 Nubenolide acetate 86.96
C00021053 Subexpinnatin C 86.67
C00042888 Pulicanol 86.67
C00013043 [3aS-(3aalpha,5abeta,7alpha,9balpha)]-7-(Acetyloxy)-3a,4,5,5a,6,7,8,9b-octahydro-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
2alpha-Acetoxysphaerantholide		 86.36
C00013057 beta-Cyclotulipinolide
[3aR-(3aalpha,4alpha,5abeta,9aalpha,9bbeta)]-4-(Acetyloxy)decahydro-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one		 86.36
C00016029 2,3-Dihydroalbocycline 86.36
C00016220 7-O-Demethyl-18-hydroxy-albocycline
Oxycineromycin B		 86.36
C00020730 Penziafulvenolide 86.36
C00021789 3beta-Acetoxy-9(12)-capnellene-8beta,10alpha-diol 86.36
C00022138 Albocycline
Ingramycin		 86.36
C00023180 Eupalinilide D 86.36
C00003105 Buddledin A 86.05
C00003378 Tulipinolide 86.05
C00011382 9-Oxo-5-acetoxynerolidol 86.05
C00011659 Acetoxydelobanone 86.05
C00012001 8-Acetoxyelemol
8alpha-Acetoxyelemol		 86.05
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 86.05
C00013092 Decipienin H
[3R-(3alpha,3abeta,5aalpha,6alpha,7alpha,9abeta,9balpha)]-3a,4,5,5a,6,7,9a,9b-Octahydro-3,6,7-trihydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one		 86.05
C00013095 Decipienin E
(3alpha,3abeta,5aalpha,6beta,9alpha,9abeta,9balpha)-3a,4,5,5a,6,9,9a,9b-Octahydro-3,6,9-trihydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one		 86.05
C00020354 Cyclokessyl acetate 86.05
C00020363 Liguloxidol acetate 86.05
C00020402 Watsonol B 86.05
C00020617 1alpha,10alpha-Epoxy-2-oxo-3,11(13)-guaiadien-12,6alpha-olide 86.05
C00020831 1,10beta-Epoxyachillin 86.05
C00020904 1beta,10beta-Epoxydehydroleucodin 86.05
C00021913 4-Acetoxy-10-hydroxy-2,8-neolemnadien-5-one 86.05
C00030113 Dendronobilin L 86.05
C00039299 Guai-6-ene 86.05
C00041308 Acetyl neobritannilactone B 86.05
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