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


and

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




INPUT WORD = C00012687 , 50% or more
[ Metabolite Name : [1R-(1alpha,4beta,4abeta,7alpha,8alpha,8aalpha)]-4-Bromodecahydro-1,4a-dimethyl-7-(1-methylethyl)-1,8-naphthalenediol diacetate , Austradiol diacetate ]
Number of matched data : 96

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012779 (1alpha,2beta,4abeta,5beta,8aalpha)-(+-)-decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1,5-naphthalenediol diacetate 91.84
C00042885 Pulicanaral A
(+)-Pulicanaral A		 88.24
C00012868 Subcordatolide C
[3aR-(3aalpha,4alpha,4aalpha,8beta,8abeta,9aalpha)]-Dodecahydro-8-hydroxy-8a-methyl-3,5-bis(methylene)-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-propanoic acid		 88.00
C00022269 3alpha-Hydroxygomeric acid 88.00
C00000273 Nagilactone F 87.76
C00003187 Shiromodiol diacetate 87.76
C00012686 Austradiol acetate
[1R-(1a,4beta,4abeta,7alpha,8alpha,8aalpha)]-4-Bromodecahydro-1,4a-dimethyl-7-(1-methylethyl)-1,8-naphthalenediol 8-acetate		 87.76
C00012847 Decahydro-alpha,4a-dimethyl-8-methylene-7-[(3-methyl-1-oxo-2-butenyl)oxy]-2-naphthaleneacetic acid 87.76
C00012849 Decahydro-alpha,4a-dimethyl-8-methylene-7-(2-methyl-1-oxopropoxy)-2-naphthaleneacetic acid 87.76
C00012850 Decahydro-alpha,4a-dimethyl-8-methylene-7-(3-methyl-1-oxobutoxy)-2-naphthaleneacetic acid 87.76
C00012866 (+)-beta-Cyclopyrethrosin
beta-Cyclopyrethrosin
[3aR-(3aalpha,4alpha,4aalpha,8beta,8abeta,9abeta)]-4-(Acetyloxy)decahydro-8-hydroxy-8a-methyl-3,5-bis(methylene)-naphtho[2,3-b]furan-2(3H)-one		 87.76
C00012869 Dihydro-beta-cyclopyrethrosin
[3R-(3alpha,3aalpha,4alpha,4aalpha,8beta,8abeta,9abeta)]-4-(Acetyloxy)decahydro-8-hydroxy-3,8a-dimethyl-5-methylene-naphtho[2,3-b]furan-2(3H)-one		 87.76
C00012982 beta-Liriodenolide
[3aR-(3aalpha,4beta,5abeta,6beta,9aalpha,9bbeta)]-4-(Acetyloxy)decahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-naphtho[1,2-b]furan-2(3H)-one		 87.76
C00013088 [5aR-(5aalpha,6alpha,8alpha,9abeta,9balpha)]-8-(Acetyloxy)-5,5a,6,7,8,9,9a,9b-octahydro-6-hydroxy-3-(hydroxymethyl)-5a-methyl-9-methylenenaphtho[1,2-b]furan-2(4H)-one 87.76
C00020238 Petasipalin A 87.76
C00021595 3,11-Diacetoxy-2-bromo-beta-chamigrene 87.76
C00021619 Acetoxyintricatol 87.76
C00021887 1,10-Diacetoxy-3(15)-gymnomitrene 87.76
C00022297 Gomeric acid 87.76
C00022494 2beta,3beta-Dihydroxy-8(17),13Z-labdadien-15-oic acid 87.76
C00042714 Luzodiol
(+)-Luzodiol		 87.76
C00042883 Pulicanadiene C
(-)-Pulicanadiene C		 87.76
C00045447 Vitexifolin D 87.76
C00046709 Dactylomelol 87.76
C00012063 [1R-[1R*,4R*,6R*,7R*(Z),8R*,11R*]]-8-(1-Hydroxy-1-methylethyl)-4,11-dimethyl-5,12-dioxatricyclo[9.1.0.04,6]dodec-7-yl ester 2-methyl-2-butenoic acid 86.54
C00013097 Vahlenin
(Dodecahydro-6,9-dihydroxy-5a-methyl-3-methylene-2-oxonaphtho[1,2-b]furan-9-yl)methyl ester 2-methyl-2-propenoic acid		 86.54
C00011756 Millefin 86.27
C00011976 11,13-Dehydromelitensin diacetate 86.27
C00023383 Sterebin B 86.27
C00003386 Vernoflexin
Vernoflexine
Zaluzanin C senecioate		 86.00
C00013084 [5aR-(5aalpha,6alpha,8alpha,9beta,9abeta,9balpha)]-8-(Acetyloxy)-5,5a,6,7,8,9,9a,9b-octahydro-6,9-dihydroxy-3-(hydroxymethyl)-5a,9-dimethylnaphtho[1,2-b]furan-2(4H)-one 86.00
C00020511 Aguerin A 86.00
C00020512 Aguerin B 86.00
C00020800 Vernudifloride 86.00
C00020824 8alpha-Isovaleryloxyeremanthine 86.00
C00020890 Arctodecurrolide 86.00
C00022380 8alpha,13R-Epoxy-14-labden-19-oic acid 86.00
C00022516 ent-8beta,17-Epoxy-3-oxo-13Z-labden-15-oic acid 86.00
C00030926 Paralemnolin F
(-)-Paralemnolin F		 86.00
C00032500 Vitexifolin E 86.00
C00038123 10-Hydroxykahukuene B
(+)-10-Hydroxykahukuene B		 86.00
C00042881 Pulicanadiene A
(+)-Pulicanadiene A		 86.00
C00000532 Betaenone E 85.71
C00003380 epi-Tulipinolide diepoxide 85.71
C00011394 11-Dimethyl-3-[(acetyloxy)methyl]-7 2,6,11-dodecatriene-1,5,10-triol 1-acetate 85.71
C00011554 (E,E)-(-)-2-[2-(2,2-Dimethyl-6-methylenecyclohexyl)ethyl]-1,3-butadiene-1,4-diol diacetate 85.71
C00012446 Caucalol diacetate 85.71
C00012447 (-)-Neocaucalol diacetate
Neocaucalol diacetate		 85.71
C00012696 3-O-Angeloylcuauhtemone
Cuauhtemone-3-angelicate
[1S-[1alpha,2alpha(Z),4abeta,8aalpha]]-Decahydro-1-hydroxy-1,4a-dimethyl-7-(1-methylethylidene)-6-oxo-2-naphthalenyl ester 2-methyl-2-butenoic acid		 85.71
C00012721 (-)-Coralloidin D
Coralloidin D
(R)-2-(3,4,4a,5,6,7-Hexahydro-4a,8-dimethyl-2(1H)-naphthalenylidene)-1,3-propanediol diacetate		 85.71
C00012961 Montathanolide
[3aS-(3aalpha,5abeta,6beta,8beta,9bbeta)]-8-(Acetyloxy)-3a,4,5,5a,6,7,8,9b-octahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 85.71
C00012990 [3aS-(3aalpha,5abeta,7alpha,9aalpha,9balpha)]-7-(Acetyloxy)decahydro-9a-hydroxy-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one 85.71
C00012991 [3aS-(3aalpha,5abeta,7alpha,9aalpha,9balpha)]-7-(Acetyloxy)decahydro-9a-hydroperoxy-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one
2alpha-Acetoxy-5alpha-hydroperoxyisosphaerantholide		 85.71
C00012997 Nitrosin
[3R-(3alpha,3abeta,5aalpha,6alpha,9abeta,9balpha)]-6-(Acetyloxy)decahydro-9a-hydroxy-3,5a-dimethyl-9-methylenenaphtho[1,2-b]furan-2(3H)-one		 85.71
C00013002 Torrentin
[3S-(3alpha,3aalpha,5abeta,6beta,8beta,9bbeta)]-8-(Acetyloxy)-3a,4,5,5a,6,7,8,9b-octahydro-6-hydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one		 85.71
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		 85.71
C00013074 8alpha-Acetoxytaurin
(3S,3aS,5aR,8R,9bS)-8-(Acetyloxy)-3a,5,5a,7,8,9b-hexahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,6(3H,4H)-dione		 85.71
C00016388 (+)-Phomopsidin
Fungicidal TUF 95F47
Phomopsidin
TUF 95F47		 85.71
C00020253 2alpha-Angeloxyanhydrooplopanone 85.71
C00020587 Arteglasin B 85.71
C00020599 Artefransin 85.71
C00020854 Solstitialin A 13-acetate 85.71
C00020895 Calocephalin acetate 85.71
C00021406 Lapidin 85.71
C00022209 Isoconcinndiol 85.71
C00022210 Venustanol 85.71
C00022242 (ent-6alpha,8alpha,13E)-6,8-Dihydroxy-13-labden-15-oic acid 85.71
C00022245 7alpha,8-dihydroxy-5beta,8betaH,9betaH,10alpha-Labdan-15-oic acid 85.71
C00022434 8alphaH,ent-3beta-Hydroxy-17-oxo-13Z-labden-15oic acid 85.71
C00022435 8alphaH,ent-3eta,17-Dioxo-13Z-labden-15-oic acid 85.71
C00022436 8betaH,ent-3beta-Hydroxy-17-oxo-13Z-labden-15oic acid 85.71
C00022487 2-Oxo-8(17),13Z-labdadien-15-oic acid 85.71
C00022492 3-Oxo-18-hydroxy-8(17),13Z-labdadien-15-oic acid 85.71
C00022515 ent-3beta-Hydroxy-8(17),13Z-labdadien-15-oic acid 85.71
C00022522 Dehydropinifolic acid
8(17),13-labdadien-15,18-dioic acid		 85.71
C00022526 Guamaiac acid
ent-8(17),13-labdadien-15,18-dioic acid		 85.71
C00022742 ent-3beta,7beta-Dihydroxy-8(17),13-labdadiene-15-oic acid 85.71
C00023303 Junicedric acid 85.71
C00023326 ent-13E-Labdene-2alpha,3alpha,8alpha,15-tetrol 85.71
C00023327 2alpha,3alpha-Dihydroxycativic acid 85.71
C00023333 3beta,7alpha-Dihydroxy-8(17)-labden-15-oic acid 85.71
C00023335 3beta,8alpha-Dihydroxy-13E-labden-15-oic acid 85.71
C00023451 1(10),13Z-Halimadiene-15,18-dioic acid 85.71
C00029599 8beta,13beta-Oxidoeperu-14-en-18-oic acid
(-)-8.beta,13.beta-Oxidoeperu-14-en-18-oic acid		 85.71
C00030925 Paralemnolin E
(+)-Paralemnolin E		 85.71
C00037497 Methyl labd-13-en-15-oate 85.71
C00040199 Salograviolide B 85.71
C00041229 (9Z,11S,16R)-Dihydroxyoctadeca-9,17-dien-12,14-diyn-1-yl acetate 85.71
C00041322 Agathic acid 85.71
C00042882 Pulicanadiene B
(+)-Pulicanadiene B		 85.71
C00044939 Moponeol A 85.71
C00044940 Moponeol B 85.71
C00045294 Dunniana acid A
(+)-Dunniana acid A		 85.71
C00046710 Dactylopyranoid
(-)-Dactylopyranoid		 85.71
C00048665 Clavirolide C 85.71
C00049702 Algoane
(+)-Algoane		 85.71
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