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


and

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




INPUT WORD = C00017307 , 50% or more
[ Metabolite Name : [4S-[4alpha(Z),4aalpha,5alpha,6alpha(Z),8aalpha]]-4,4a,5,6,7,8,8a,9-Octahydro-3,4a-dimethyl-4,6-bis[(2-methyl-1-oxo-2-butenyl)oxy]-naphtho[2,3-b]furan-5-carboxylic acid ]
Number of matched data : 50

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00017341 [4aS-[4aalpha,5alpha,6alpha(Z),7alpha(Z),8aalpha]]-4,4a,5,6,7,8,8a,9-Octahydro-3,4a,5-trimethylnaphtho[2,3-b]furan-6,7-diyl ester 2-methyl-2-butenoic acid 92.42
C00017345 [4aS-[4aalpha,5alpha,6beta(Z),7alpha(Z),8abeta]]- 4,4a,5,6,7,8,8a,9-Octahydro-3,4a,5-trimethylnaphtho[2,3-b]furan-6,7-diyl ester 2-methyl-2-butenoic acid 90.91
C00017356 [4aS-[4aalpha,5alpha(Z),6alpha(Z),8aalpha]]-4,4a,5,6,7,8,8a,9-Octahydro-3,4a-dimethyl-6-[(2-methyl-1-oxo-2-butenyl)oxy]-naphtho[2,3-b]furan-5-acetic acid 1-methyl-1-propenyl ester 90.91
C00017355 [4aR-[4aalpha,5alpha,6alpha(Z),8aalpha,9alpha]]-4,4a,5,6,7,8,8a,9-Octahydro-3,4a,5-trimethyl-9-[(3-methyl-1-oxo-2-butenyl)oxy]naphtho[2,3-b]furan-6-yl ester 2-methyl-2-butenoic acid 89.39
C00017363 (-)-Kablicin
Kablicin
Kablicine		 89.39
C00017444 (4alpha,4aalpha,5alpha,7alpha,8beta,8abeta)-(-)-7-Hydroxy-4,4a,5,6,7,8,8a,9-octahydro-3,4a,5-trimethyl-4-(2-methyl-1-oxopropoxy)-9-oxonaphtho[2,3-b]furan-8-yl ester 3-methyl-2-butenoic acid 89.39
C00022549 6beta-Angeloyloxyisochiliolide lactone 88.24
C00022552 7beta-Angeloyloxyisochiliolide lactone 88.24
C00017344 [4aS-[4aalpha,5alpha,6beta,7alpha(Z),8abeta]]-4,4a,5,6,7,8,8a,9-octahydro-3,4a,5-trimethyl-6-[(3-methyl-1-oxo-2-butenyl)oxy]naphtho[2,3-b]furan-7-yl ester 2-methyl-2-butenoic acid 87.88
C00017353 (S)-Furanopetasitin 87.88
C00021357 Homofukinolide 87.88
C00022653 CID is old! 87.88
C00021152 Pulchelloid D 86.76
C00022399 Angeloylespinosanolide 86.36
C00022570 Pteroneeniol 86.36
C00022734 (ent-2alpha,3beta,13Z)-3-Angeloyloxy-8(17),13-labdadiene-2,15,16,18-tetrol 86.36
C00033787 Diversolide A
(-)-Diversolide A		 86.36
C00011994 Zinaflorin I 85.29
C00049153 Eremopetasitenin C2
(-)-Eremopetasitenin C2		 85.29
C00017315 [4S-(4alpha,4aalpha,5alpha,6alpha)]-4,4a,5,6,7,9-Hexahydro-3,4a,5-trimethyl-9-oxonaphtho[2,3-b]furan-4,6-diyl ester 2-methyl-2-propenoic acid 84.85
C00017352 [4S-[4alpha,4aalpha,5alpha,6alpha(Z),8aalpha]]-4-(Acetyloxy)-4,4a,5,6,7,8,8a,9-octahydro-3,4a,5-trimethylnaphtho[2,3-b]furan-6-yl ester 2-methyl-2-butenoic acid 84.85
C00017378 [1aR-[1aalpha,3alpha(Z),4beta,4abeta,5beta,9aS*]]-5-(acetyloxy)-1a,2,4,4a,5,9-Hexahydro-4,4a,6-trimethyl-3H-oxireno[8,8a]naphtho[2,3-b]furan-3-yl ester 2-methyl-2-butenoic acid 84.85
C00020559 Talassin A 84.85
C00022398 Espinosanolide 2-methylbutyrate 84.85
C00022403 Angeloylgutespinolide 84.85
C00022647 Gutierrezianolic acid 2-methylbutyrate 84.85
C00033788 Diversolide B
(-)-Diversolide B		 84.85
C00037751 Rouyolide A
(+)-Rouyolide A		 84.85
C00038296 5'-Tigloyleupahakonenin B
5'-O-Tigloyleupahakonenin B		 84.85
C00020535 Isopericomin 83.82
C00049156 Eremopetasitenin D2
(+)-Eremopetasitenin D2		 83.82
C00011796 [3aR-[3aR*,4R*[E(E)],6E,9S*,10E,11aR*]]-2-[[(2,3,3a,4,5,8,9,11a-Octahydro-9-hydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl)oxy]carbonyl]-2-butenyl ester 2-(hydroxymethyl)-2-butenoic acid 83.58
C00023212 [2S-[2alpha(Z),4aalpha,6alpha,8beta(S*),8abeta]]-8a-[(Acetyloxy)methyl]decahydro-6-hydroxy-8-(3-hydroxy-3-methyl-4-pentenyl)-4,4-dimethyl-7-methylene-2-naphthalenyl ester 2-methyl-2-butenoic acid 83.58
C00044586 Briarellin P
(-)-Briarellin P		 83.58
C00003160 Laserpitin 83.33
C00012194 Liacylindrolide 83.33
C00012287 Melcanthin A 83.33
C00012290 Melcanthin F 83.33
C00012953 [3aR-[3aalpha,4alpha(E),6beta,8alpha,8aalpha,9aalpha]]-6,8-bis(Acetyloxy)-2,3,3a,4,6,7,8,8a,9,9a-decahydro-5,8a-dimethyl-3-methylene-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid 83.33
C00017080 L 669262 83.33
C00017351 6beta-Acetoxyfuranoeremophilan-3alpha-yl angelate 83.33
C00021326 Triflorestevione 83.33
C00021327 Rastevione 83.33
C00022402 2-Methylbutanoyl gutespinolide 83.33
C00022404 2-Epimethylbutanoyl gutespinolide 83.33
C00035629 Gordonoside A
(-)-Gordonoside A		 83.33
C00037756 Rouyolide F
(+)-Rouyolide F		 83.33
C00046616 Anthoptilide C
(+)-Anthoptilide C		 83.33
C00037754 Rouyolide D
(+)-Rouyolide D		 82.61
C00037755 Rouyolide E
(+)-Rouyolide E		 82.61
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