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


and

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




INPUT WORD = C00010963 , 50% or more
[ Metabolite Name : [1S-[1alpha(E),3(E),5beta,6alpha]]-5-hydroxy-6-(1-methylethyl)-3-[[(2-methyl-1-oxo-2-butenyl)oxy]methyl]-4-oxo-2-cyclohexen-1-yl ester ]
Number of matched data : 79

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00013096 Decipienin D
[3alpha(Z),3abeta,5aalpha,6beta,9alpha,9abeta,9balpha]-(-)-2,3,3a,4,5,5a,6,9,9a,9b-Decahydro-6,9-dihydroxy-3,5a,9-trimethyl-2-oxonaphtho[1,2-b]furan-3-yl ester 2-methyl-2-butenoic acid		 87.04
C00011985 [3aS-[3aalpha,4beta,5beta,6alpha,7alpha(Z),7abeta]]- 6-Ethenyl-5-(1-formylethenyl)octahydro-4-hydroxy-6-methyl-3-methylene-2-oxo-7-benzofuranyl ester 2-methyl-2-butenoic acid 86.79
C00012419 Pycnolide 86.54
C00010964 [1S-[1alpha(E),3(E),5beta,6alpha]]-5-(acetyloxy)-6-(1-methylethyl)-3-[[(2-methyl-1-oxo-2-butenyl)oxy]methyl]-4-oxo-2-cyclohexen-1-yl ester 86.21
C00013090 Trichomatolide A
[4R-[4alpha(E),5aalpha,6alpha,9abeta,9balpha]]-2,4,5,5a,6,7,8,9,9a,9b-Decahydro-6-hydroxy-3-(hydroxymethyl)-5a-methyl-9-methylene-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid		 85.19
C00013093 Decipienin G
[3R-[3alpha(Z),3abeta,5aalpha,6alpha,7alpha,9abeta,9balpha]]-2,3,3a,4,5,5a,6,7,9a,9b-Decahydro-6,7-dihydroxy-3,5a,9-trimethyl-2-oxonaphtho[1,2-b]furan-3-yl ester 2-methyl-2-butenoic acid		 85.19
C00013094 (-)-Decipienin F
Decipienin F
[3S-[3alpha(Z),3aalpha,5aalpha,6alpha,9alpha,9abeta,9balpha]]- 2,3,3a,4,5,5a,6,9,9a,9b-Decahydro-6,9-dihydroxy-3,5a,9-trimethyl-2-oxonaphtho[1,2-b]furan-3-yl ester 2-methyl-2-butenoic acid		 85.19
C00021030 Hymenoratin B 85.19
C00021061 Fastigilin A 85.19
C00035782 15-O-Isovaleroyl-2alpha-hydroxyamphoricarpolide 85.19
C00003262 Eriolangin 84.91
C00003334 Molephantinin 84.91
C00011984 [3aS-[3aalpha,4beta(Z),5beta,6alpha,7alpha,7abeta]]- 6-Ethenyl-5-(1-formylethenyl)octahydro-7-hydroxy-6-methyl-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-butenoic acid 84.91
C00011992 Zinaflorin V 84.91
C00012057 Zinaflavin H 84.91
C00012208 Grazielia acid 84.91
C00023191 8beta-Tigloyloxy-3beta,14-dihydroxy-6betaH,7alphaH-germacra-1(10)Z,4E-11(13)-trien-6,12-olide 84.91
C00003339 Nobilin 84.62
C00011663 (R)-5-(1,5-dimethyl-4-hexenyl)-4-hydroxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl ester 3-methylbutanoic acid 84.62
C00011780 Mollisorin A 84.62
C00020243 2alpha-Angeloyloxy-9-oxoisoanhydrooplopanone 84.62
C00020479 Angeloylcumambrin B 84.62
C00021727 alpha-Perezol 84.62
C00021728 beta-Perezol 84.62
C00036423 1alpha,4alpha,10alpha-Trihydroxy-9alpha-angeloyloxyguaia-2,11(13)-dien-12,6alpha-olide 83.93
C00011840 Douglasin 83.64
C00003335 Multigilin 83.33
C00003384 Vernodalin 83.33
C00011874 Deltoidin B 83.33
C00012027 (+)-Zinaflavin B
Zinaflavin B		 83.33
C00012061 11,13-Dihydrovernodalin 83.33
C00020481 Hydrobahia III 83.33
C00002119 Senkirkine 83.02
C00011844 Calein F
Caleine F		 83.02
C00011847 Eupachifolin A 83.02
C00011998 [3aR-[3aalpha,4beta(Z),6alpha,7beta,7abeta]]-6-Ethenyloctahydro-6-methyl-a,3-bis(methylene)-4-[(2-methyl-1-oxo-2-butenyl)oxy]-2-oxo-7-benzofuranacetic acid 83.02
C00011999 [3aR-[3aalpha,4beta(E),6alpha,7beta,7abeta]]-6-ethenyloctahydro-6-methyl-a,3-bis(methylene)-4-[(2-methyl-1-oxo-2-butenyl)oxy]-2-oxo-7-benzofuranacetic acid 83.02
C00012052 [3aR-[3aalpha,4alpha(Z),5beta,6alpha,7alpha,7aalpha]]- 6-Ethenyloctahydro-3a,5-dihydroxy-6-methyl-3-methylene-7-(1-methylethenyl)-2-oxo-4-benzofuranyl ester 2-methyl-2-butenoic acid 83.02
C00012213 Germanin A 83.02
C00012256 Montafrusin
Montafrusin A		 83.02
C00012258 Zoapatanolide A 83.02
C00012259 Zoapatanolide B 83.02
C00012264 Gigantanolide B 83.02
C00012342 Ineupatorolide B
Nepalolide C		 83.02
C00020624 [3aS-[3aalpha,7alpha(E),7abeta,8abeta,8balpha,8cbeta]]-2,3,3a,4,5,7,7a,8a,8b,8c-Decahydro-6,8a-dimethyl-3-methylene-2-oxooxireno[2,3]azuleno[4,5-b]furan-7-yl ester 2-methyl-2-butenoic acid 83.02
C00002124 Triangularine 82.69
C00002127 Usaramine 82.69
C00011662 Hydroxyperezone monoangelate 82.69
C00011798 3-Epinobilin 82.69
C00011800 3-Dehydronobilin 82.69
C00011981 Zinarosin 82.69
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 82.69
C00012103 Deltoidin A 82.69
C00012215 Wunderolide 82.69
C00012360 Cyathin B5
Tanacin
Tanacin		 82.69
C00012874 Pulchellin F
[3aR-[3aalpha,4aalpha,6beta,7alpha(Z),8abeta,9aalpha]]-Dodecahydro-6-hydroxy-8a-methyl-3,5-bis(methylene)-2-oxonaphtho[2,3-b]furan-7-yl ester 2-methyl-2-butenoic acid		 82.69
C00012979 Chapinolin
[3aR-[3aalpha,4alpha(Z),5abeta,6beta,9aalpha,9bbeta]]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid		 82.69
C00012983 Arturin
[3aR-[3aalpha,4beta(Z),5abeta,6beta,9aalpha,9bbeta]]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid		 82.69
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		 82.69
C00013210 (-)-Eriolanin
Eriolanin
[3aalpha,4alpha,5(S*),7aalpha]-(-)- 2,3,3a,4,7,7a-Hexahydro-6-(hydroxymethyl)-5-(4-hydroxy-1-methylbutyl)-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-propenoic acid		 82.69
C00020729 Prutenin 82.69
C00020821 Badkhyzin 82.69
C00020943 [3R-(3alpha,3aalpha,4alpha,4abeta,7abeta,8alpha,9aalpha)]-2,3,3a,4,4a,7,7a,8,9,9a-Decahydro-3,5,8-trimethyl-2,7-dioxoazuleno[6,5-b]furan-4-yl ester 3-methyl-2-butenoic acid 82.69
C00021422 14-Hydroxyvaginatin 82.69
C00023154 Crocetine dimethyl ester
8,8'-Diapo-psi,psi-carotenedioic acid dimethyl ester		 82.69
C00026207 Isorosmarinine 82.69
C00026226 Sarracine N-oxide 82.69
C00033552 2-Hydroxy-2-(2-hydroxy-4-methylphenyl)propane-1,3-diyl (2Z,2'Z)- bis(2-methylbut-2-enoate)
Hofmeisterin IV		 82.69
C00033593 8alpha-Angeloyloxydouglanin 82.69
C00033596 8alpha-Tigloyloxydouglanin 82.69
C00038458 Annuolide F 82.69
C00040218 Sarcostolide A
(+)-Sarcostolide A		 82.69
C00040219 Sarcostolide B
(+)-Sarcostolide B		 82.69
C00040220 Sarcostolide C
(+)-Sarcostolide C		 82.69
C00040318 Sinularolide B
(-)-Sinularolide B		 82.69
C00040555 Trigonochinene A
(+)-Trigonochinene A		 82.69
C00040556 Trigonochinene B
(-)-Trigonochinene B		 82.69
C00048995 Hypoestene
(-)-Hypoestene		 82.69
C00050382 Lobophynin C
(+)-Lobophynin C		 82.69
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