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


and

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




INPUT WORD = C00020863 , 50% or more
[ Metabolite Name : [3aS-(3aalpha,4alpha,5alpha,9beta,9aalpha,9bbeta)]-4,5-Bis(acetyloxy)-3a,4,5,9,9a,9b-hexahydro-9-hydroxy-6,9-dimethyl-3-methylene-azuleno[4,5-b]furan-2(3H)-one ]
Number of matched data : 50

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00020861 [3aS-(3aalpha,4alpha,5alpha,9alpha,9aalpha,9bbeta)]-4,5-Bis(acetyloxy)-3a,4,5,9,9a,9b-hexahydro-9-hydroxy-6,9-dimethyl-3-methylene-azuleno[4,5-b]furan-2(3H)-one 98.15
C00020486 8-Acetoxy-4-anhydroathamontanolide 94.44
C00020862 [3aS-(3aalpha,4alpha,5alpha,9alpha,9aalpha,9bbeta)]-5-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-9-hydroxy-6,9-dimethyl-3-methylene-2-oxoazuleno[4,5-b]furan-4-yl ester 2-methylpropanoic acid 93.10
C00020864 [3aS-(3aalpha,4alpha,5alpha,9beta,9aalpha,9bbeta)]-5-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-9-hydroxy-6,9-dimethyl-3-methylene-2-oxoazuleno[4,5-b]furan-4-yl ester 2-methylpropanoic acid 93.10
C00020601 Christinine 90.91
C00012343 Balsamin 90.74
C00020866 Heliopsolide
[3aR-[3aalpha,4alpha,5beta(Z),9alpha,9aalpha,9bbeta]]-2,3,3a,4,5,9,9a,9b-Octahydro-4,9-dihydroxy-6,9-dimethyl-3-methylene-2-oxoazuleno[4,5-b]furan-5-yl ester 2-methyl-2-butenoic acid		 90.74
C00033605 9alpha-Acetoxycumambrin A
(+)-9alpha-Acetoxycumambrin A		 90.74
C00043496 Eupachinilide D
(-)-Eupachinilide D		 90.74
C00020868 [3aS-[3aalpha,4alpha,5beta(Z),9beta,9aalpha,9bbeta]]-4-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-9-hydroxy-6,9-dimethyl-3-methylene-2-oxoazuleno[4,5-b]furan-5-yl ester 2-methyl-2-butenoic acid 90.00
C00020487 [3aS-(3aalpha,4alpha,5alpha,9aalpha,9bbeta)]-5-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-6-methyl-3,9-bis(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester 2-methylpropanoic acid 89.29
C00020590 Bacchariolide B 89.09
C00020789 [3aR-[3aalpha,4beta(R*),9aalpha,9bbeta]]-2,5-Dihydro-5-hydroxy-2,3,3a,4,5,7,9a,9b-octahydro-6,9-dimethyl-3-methylene-2-oxoazuleno[4,5-b]furan-4-yl ester 3-furancarboxylic acid 89.09
C00020822 Schischkinin A 89.09
C00011784 Carmelin 88.89
C00012104 Eupassopilin 88.89
C00020506 8alpha-Acetoxyzaluzanin D 88.89
C00020552 Vicolide A 88.89
C00020565 5-Desoxypumilim 88.89
C00021178 Britanin(-)-
Britannin		 88.89
C00023178 Eupalinilide B 88.89
C00020865 [3aS-(3aalpha,4alpha,5alpha,9beta,9aalpha,9bbeta)]-5-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-9-hydroxy-6,9-dimethyl-3-methylene-2-oxoazuleno[4,5-b]furan-4-yl ester 2-methylbutanoic acid 88.33
C00020867 [3aS-[3aalpha,4alpha,5beta(Z),9alpha,9aalpha,9bbeta]]-4-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-9-hydroxy-6,9-dimethyl-3-methylene-2-oxoazuleno[4,5-b]furan-5-yl ester 2-methyl-2-butenoic acid 88.33
C00040851 8,9-di-O-Acetylanthemolide B
(-)-8,9-di-O-Acetylanthemolide B		 87.93
C00020696 Bacchariolide A 87.72
C00043498 Eupachinilide G
(-)-Eupachinilide G		 87.72
C00020878 Pumilin 87.50
C00033648 Anthemolide D
(+)-Anthemolide D		 87.50
C00043494 Eupachinilide A
(-)-Eupachinilide A		 87.50
C00003282 Euponin 87.27
C00020588 Subacaulin 87.27
C00011814 Zexbrevin D 87.04
C00012054 [3aS-(3aalpha,4alpha,5beta,6beta,7alpha,7aalph)]- 6-Ethenyloctahydro-3a,4-dihydroxy-6-methyl-3-methylene-7-(1-methylethenyl)-2-oxo-5-benzofuranyl ester 3-methyl-2-butenoic acid 87.04
C00012257 (+)-Montafrusin B
Montafrusin B		 87.04
C00020431 Bishopantholide 87.04
C00020791 Petiolaride 87.04
C00020957 3-O-Angeloylcarolenalone 87.04
C00020958 3-O-Tigloylcarolenalone 87.04
C00021072 Inuchinenolide C 87.04
C00021156 Tetraneurin F 87.04
C00021165 Hymenograndin 87.04
C00021172 4-Acetylchamissonolide 87.04
C00029910 Carlaolide B 87.04
C00033933 Hydruntinolide A
(-)-Hydruntinolide A		 87.04
C00034083 Notoserolide B
-O-Senecioylaustricin		 87.04
C00045935 Ferupennin D
(-)-Ferupennin D		 87.04
C00020558 Olgin (sesquiterpene) 86.21
C00023177 Eupalinilide A 86.21
C00020602 Guevariolide 85.96
C00043495 Eupachinilide B
(-)-Eupachinilide B		 85.96
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