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


and

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




INPUT WORD = C00013049 , 50% or more
[ Metabolite Name : [3aS-(3aalpha,5abeta,9balpha)]-3a,5a,6,7,8,9b-Hexahydro-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2,5(3H,4H)-dione , 9-Oxotournefortiolide ]
Number of matched data : 81

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00013038 Magnolialide
Splendolide
[3aS-(3aalpha,5abeta,6beta,9bbeta)]-3a,4,5,5a,6,7,8,9b-Octahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 97.37
C00013039 [3aS-(3aalpha,5aalpha,6alpha,9balpha)]- 3a,4,5,5a,6,7,8,9b-Octahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one 97.37
C00013047 [3aS-(3aalpha,5beta,5abeta,9balpha)]-3a,4,5,5a,6,7,8,9b-Octahydro-5-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
9beta-Hydroxytournefortiolide		 97.37
C00013054 Artesin
Artesin(terpene)
Artemalin
[3S-(3alpha,3aalpha,5abeta,6beta,9bbeta)]-3a,4,5,5a,6,7,8,9b-Octahydro-6-hydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one		 97.37
C00012180 Herbolide H 94.74
C00012344 Quadrangolide 94.74
C00012836 3-Oxocostusic acid
(2R-cis)-1,2,3,4,4a,5,6,7-Octahydro-4a,8-dimethyl-alpha-methylene-7-oxo-2-naphthaleneacetic acid		 94.74
C00012839 (2S-cis)-1,2,3,4,4a,5,6,7-Octahydro-4a,8-dimethyl-alpha-methylene-4-oxo-2-naphthaleneacetic acid 94.74
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		 94.74
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		 94.74
C00013042 2alpha-Hydroxysphaerantholide
[3aS-(3aalpha,5abeta,7alpha,9balpha)]-3a,4,5,5a,6,7,8,9b-Octahydro-7-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 94.74
C00013044 Arbusculin C
[3aS-(3aalpha,5abeta,9aalpha,9bbeta)]-Decahydro-9a-hydroxy-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one		 94.74
C00013056 Rothin A
[3aR-(3aalpha,4alpha,5abeta,9bbeta)]-3a,4,5,5a,6,7,8,9b-Octahydro-4-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 94.74
C00013058 Herbolide G
[3S-(3alpha,3aalpha,5beta,5abeta,9aalpha,9bbeta)]-3a,4,5,5a,6,7,9a,9b-Octahydro-5-hydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one		 94.74
C00013081 Barrelierin
Gracilin
Taurin
[3S-(3alpha,3aalpha,5abeta,9bbeta)]-3a,5,5a,7,8,9b-Hexahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,6(3H,4H)-dione		 94.74
C00013082 Finitin
[3S-(3alpha,3aalpha,5abeta,9balpha)]-3a,5,5a,7,8,9b-Hexahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,6(3H,4H)-dione		 94.74
C00020924 Dihydropseudoivalin 94.74
C00021697 8-epi-Ivangustin 94.74
C00021704 4beta,5alpha-Epoxy-4,5-cis-inunolide 94.74
C00033643 Annuolide D 94.74
C00034365 11-epi-Artesin 94.74
C00036670 9beta-Acetoxyeudesma-4,11(13)-dien-12-oic acid 94.74
C00049635 Epidihydropseudoivalin
(-)-Epidihydropseudoivalin		 94.74
C00013061 Dehydroisoerivanin
Alhanin
Alkhanin
[3S-(3alpha,3aalpha,5abeta,6alpha,9bbeta)]-3a,5,5a,6,7,9b-Hexahydro-6-hydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione		 92.50
C00013062 1-epi-Ludovicin C
Armexifolin
[3aS-(3aalpha,5abeta,6beta,9bbeta)]-3a,5,5a,6,7,9b-Hexahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2,8(3H,4H)-dione		 92.50
C00011758 (+)-Herbolide F
Herbolide F		 92.31
C00013211 (+)-Umbellifolide
Umbellifolide
[3aR-(3aalpha,6alpha,7aalpha)]-Tetrahydro-6-methyl-3-methylene-6-(4-oxopentyl)-2,5(3H,4H)-benzofurandione		 92.31
C00000173 Artabsin 92.11
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
C00003241 alpha-Cyclocostunolide 92.11
C00003287 (-)-Frullanolide
Tournefortiolide
[3aS-(3aalpha,5abeta,9balpha)]-3a,4,5,5a,6,7,8,9b-Octahydro-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 92.11
C00003300 7alpha-Hydroxydehydrocostus lactone 92.11
C00003355 Pseudoivalin 92.11
C00003363 Santamarin
Santamarine
Balchanin		 92.11
C00003364 Santonin
Semenen
(-)-alpha-Santonin
(-)-Santonin
a-Santonin
[3S-(3alpha,3aalpha,5abeta,9bbeta)]-3a,5,5a,9b-Tetrahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione		 92.11
C00003365 beta-Santonin
[3R-(3alpha,3abeta,5aalpha,9balpha)]-3a,5,5a,9b-Tetrahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione		 92.11
C00012035 Shonachalin D 92.11
C00012095 11beta,13-Dihydroparthenolide
Dihydroparthenolide		 92.11
C00012175 [3S-(3R*,3aR*,10E,11aR*)]-3a,5,6,8,9,11a-Hexahydro-3,10-dimethyl-6-methylene-cyclodeca[b]furan-2,7(3H,4H)-dione 92.11
C00012177 Gallicin 92.11
C00012178 [3R-(3R*,3aS*,10E,11aS*)]-3a,5,6,8,9,11a-Hexahydro-3,10-dimethyl-6-methylene-cyclodeca[b]furan-2,7(3H,4H)-dione 92.11
C00012197 Haageanolide 92.11
C00012345 4alpha,5beta-Epoxy-8-epi-inunolide 92.11
C00012388 Liabinolide 92.11
C00012393 Frutescin 92.11
C00012521 Cuprenolidol 92.11
C00012700 (+)-6alpha-Carissanol
6alpha-Carissanol
[4aS-(4aalpha,7alpha,8beta)]-4,4a,5,6,7,8-Hexahydro-8-hydroxy-7-(1-hydroxy-1-methylethyl)-1,4a-dimethyl-2(3H)-naphthalenone		 92.11
C00012701 (+)-6beta-Carissanol
[4aS-(4aalpha,7alpha,8alpha)]-4,4a,5,6,7,8-Hexahydro-8-hydroxy-7-(1-hydroxy-1-methylethyl)-1,4a-dimethyl-2(3H)-naphthalenone		 92.11
C00012728 [2S-(2alpha,4alpha,4aalpha,8abeta)]-Decahydro-4-hydroxy-4a-methyl-a,8-bis(methylene)-2-naphthaleneacetic acid
9beta-Hydroxycostic acid		 92.11
C00012831 [2R-(2alpha,4aalpha,8abeta)]-Decahydro-4a-methyl-a,8-bis(methylene)-5-oxo-2-naphthaleneacetic acid
1-Oxo-4(15),11(13)-eudesmadien-12-oic acid		 92.11
C00012835 [2R-(2alpha,4aalpha,7alpha)]-1,2,3,4,4a,5,6,7-Octahydro-7-hydroxy-4a,8-dimethyl-alpha-methylene-2-naphthaleneacetic acid 92.11
C00012840 cis-1,2,3,4,4a,5,6,7-Octahydro-8-(hydroxymethyl)-4a-methyl-alpha-methylene-2-naphthaleneacetic acid 92.11
C00012886 [3R-(3alpha,3abeta,5aalpha,9balpha)]-3a,4,5,5a,6,7,8,9b-Octahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one 92.11
C00012911 Ivangustin 92.11
C00012920 [3aS-(3aalpha,4aalpha,8abeta,9aalpha)]- 3a,4,4a,7,8,8a,9,9a-Octahydro-4a-hydroxy-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one
ent-7alpha-Hydroxydipophyllolide		 92.11
C00012928 [3aR-(3aalpha,8abeta,9aalpha)]-3a,4,6,7,8,8a,9,9a-Octahydro-5-(hydroxymethyl)-8a-methyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one 92.11
C00012930 [3aR-(3aalpha,8abeta,9aalpha)]-2,3,3a,4,6,7,8,8a,9,9a-Decahydro-8a-methyl-3-methylene-2-oxonaphtho[2,3-b]furan-5-carboxaldehyde
Isoinunal		 92.11
C00012941 [3aS-(3aalpha,8abeta,9aalpha)]-3a,7,8,8a,9,9a-Hexahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2,6(3H,4H)-dione
3-Oxodiplophyllin		 92.11
C00013031 (+)-Frullanolide
[3aR-(3aalpha,5abeta,9balpha)]-3a,4,5,5a,6,7,8,9b-Octahydro-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 92.11
C00013037 11beta,13-Dihydrosantamarin
11,13-Dihydrosantamarine
Dihydrosantamarin		 92.11
C00013040 (+)-Reynosin
Reinosin
Reynosin		 92.11
C00013041 11betaH,13-Dihydroreynosin
Dihydroreynosin
[3S-(3alpha,3aalpha,5abeta,6beta,9aalpha,9bbeta)]-Decahydro-6-hydroxy-3,5a-dimethyl-9-methylenenaphtho[1,2-b]furan-2(3H)-one		 92.11
C00013045 (+)-Oxyfrullanolide
Oxyfrullanolide		 92.11
C00013046 7alpha-Hydroxyfrullanolide
[3aR-(3aalpha,5abeta,9balpha)]-3a,4,5,5a,6,7,8,9b-Octahydro-3a-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 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
C00013080 alpha-Tetrahydro-alpha-santonin
alpha-Tetrahydrosantonin
Artepaulin
[3S-(3alpha,3aalpha,5abeta,9alpha,9aalpha,9bbeta)]-Octahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione		 92.11
C00013223 Douglanin
Douglanine
[3aS-(3aalpha,5abeta,6alpha,9aalpha,9bbeta)]-3a,4,5,5a,6,7,9a,9b-Octahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 92.11
C00020719 1alpha-Hydroxy-5alpha,11betaH-guaia-3,10(14)-dien-6alpha,12-olide 92.11
C00020724 Cumambranolide
8-Desoxycumambrin B
Maximilianin		 92.11
C00020726 10beta-Hydroxycichopumilide 92.11
C00020923 [3aR-(3aalpha,4aalpha,5alpha,9abeta)]-3a,4,4a,5,6,7,9,9a-Octahydro-5-hydroxy-5,8-dimethyl-3-methylene-azuleno[6,5-b]furan-2(3H)-one 92.11
C00020928 [3aR-(3aalpha,4aalpha,5alpha,7abeta,9abeta)]-3a,4,4a,5,6,7,7a,9a-Octahydro-5-hydroxy-5,8-dimethyl-3-methylene-azuleno[6,5-b]furan-2(3H)-one 92.11
C00021699 9beta-Hydroxy costunolide 92.11
C00021707 4-epi-Isoinuviscolide 92.11
C00022674 14-Hydroxy-desoxyivangustin 92.11
C00034362 11-epi-Gallicin 92.11
C00034363 11alpha,13-Dihydroreynosin
11-epi-Dihydroreynosin		 92.11
C00034364 11alpha,13-Dihydrosantamarin 92.11
C00036303 (+)-Dihydrofrullanolide 92.11
C00037033 Deoxyarteannuin B
Deoxyisoartemisinin C		 92.11
C00037054 Dihydrodeoxyarteannuin B 92.11
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