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


and

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




INPUT WORD = C00012839 , 50% or more
[ Metabolite Name : (2S-cis)-1,2,3,4,4a,5,6,7-Octahydro-4a,8-dimethyl-alpha-methylene-4-oxo-2-naphthaleneacetic acid ]
Number of matched data : 54

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00036670 9beta-Acetoxyeudesma-4,11(13)-dien-12-oic acid 100.00
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
C00012180 Herbolide H 97.30
C00012728 [2S-(2alpha,4alpha,4aalpha,8abeta)]-Decahydro-4-hydroxy-4a-methyl-a,8-bis(methylene)-2-naphthaleneacetic acid
9beta-Hydroxycostic acid		 97.30
C00012835 [2R-(2alpha,4aalpha,7alpha)]-1,2,3,4,4a,5,6,7-Octahydro-7-hydroxy-4a,8-dimethyl-alpha-methylene-2-naphthaleneacetic acid 97.30
C00012911 Ivangustin 94.74
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 94.74
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		 94.74
C00013049 [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		 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
C00022674 14-Hydroxy-desoxyivangustin 94.74
C00034365 11-epi-Artesin 94.74
C00012035 Shonachalin D 94.59
C00012197 Haageanolide 94.59
C00012731 Viscic acid
3alpha-Hydroxycostic acid
[2R-(2alpha,4aalpha,7beta,8abeta)]-Decahydro-7-hydroxy-4a-methyl-alpha,8-bis(methylene)-2-naphthaleneacetic acid		 94.59
C00012829 [2R-(2alpha,4aalpha,5beta,8abeta)]-Decahydro-5-hydroxy-4a-methyl-a,8-bis(methylene)-2-naphthaleneacetic acid 94.59
C00012832 Decahydro-5-hydroxy-alpha,4a-dimethyl-8-methylene-2-naphthaleneacetic acid
1lapha-Hydroxy-4(15)-eudesmen-12-oic acid		 94.59
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		 94.59
C00012881 1-Deoxyivangustin
Alloalantolactone
[3aR-(3aalpha,8abeta,9aalpha)]-3a,4,6,7,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one		 94.59
C00012885 (-)-Diplophyllin
Diplophyllin
[3aS-(3aalpha,8abeta,9aalpha)]-3a,4,6,7,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one		 94.59
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 94.59
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		 94.59
C00021699 9beta-Hydroxy costunolide 94.59
C00036303 (+)-Dihydrofrullanolide 94.59
C00036562 3-Oxoisocostic acid 94.59
C00038288 5-Bromo-2,3-dihydroxy-6-methoxybenzaldehyde 94.59
C00011758 (+)-Herbolide F
Herbolide F		 92.31
C00012729 [2R-(2alpha,3alpha,4alpha,4aalpha,8abeta)]-Decahydro-3,4-dihydroxy-4a-methyl-alpha,8-bis(methylene)-2-naphthaleneacetic acid
8beta,9beta-Dihydroxycostic acid		 92.31
C00012730 [2S-(2alpha,4alpha,4aalpha,5alpha,8abeta)]-Decahydro-4,5-dihydroxy-4a-methyl-alpha,8-bis(methylene)-2-naphthaleneacetic acid
1beta,9beta-Dihydroxycostic acid		 92.31
C00013211 (+)-Umbellifolide
Umbellifolide
[3aR-(3aalpha,6alpha,7aalpha)]-Tetrahydro-6-methyl-3-methylene-6-(4-oxopentyl)-2,5(3H,4H)-benzofurandione		 92.31
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
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		 92.11
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		 92.11
C00012931 [3R-(3alpha,3aalpha,4aalpha,5beta,6alpha,8abeta,9aalpha)]-Decahydro-6-hydroxy-3,5,8a-trimethylnaphtho[2,3-b]furan-2(3H)-one
3-Hydroxy-12,8-eudesmanolide		 92.11
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		 92.11
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 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
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		 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
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		 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
C00020804 Artausin 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
C00021696 Asperilin 92.11
C00021697 8-epi-Ivangustin 92.11
C00021707 4-epi-Isoinuviscolide 92.11
C00034363 11alpha,13-Dihydroreynosin
11-epi-Dihydroreynosin		 92.11
C00036034 alpha-Epoxy-dihydroartemisinic acid 92.11
C00046105 Macrophyllic acid D
(-)-Macrophyllic acid D		 92.11
C00046106 Macrophyllic acid E
(+)-Macrophyllic acid E		 92.11
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