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


and

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




INPUT WORD = C00020487 , 50% or more
[ Metabolite Name : [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 ]
Number of matched data : 50

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
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
C00033602 8-O-Isobutyryl-9alpha-Acetoxycumambrin B 93.10
C00020558 Olgin (sesquiterpene) 91.38
C00003348 Phantomolin 91.07
C00020486 8-Acetoxy-4-anhydroathamontanolide 91.07
C00045941 Ferupennin J
(+)-Ferupennin J		 90.00
C00045945 Ferupennin N
(+)-Ferupennin N		 90.00
C00012312 Caleurticolide acetate 89.83
C00011819 Amarin 89.47
C00011789 Peucephyllin 89.29
C00011888 [3aS-(3aR*,4S*,6R*,9S*,10R*,11aS*)]-9-Ethoxydodecahydro-6,10-dimethyl-3-methylene-2-oxo-6,9-epoxycyclodeca[b]furan-4-yl ester 2-methyl-propanoic acid 89.29
C00020482 Breviarolide 89.29
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 89.29
C00020863 [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 89.29
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
C00033604 8-O-Tigloyl-9alpha-acetoxycumambrin B 88.33
C00045942 Ferupennin K
(-)-Ferupennin K		 88.33
C00012225 Isorolandrolide 88.14
C00012308 Calein C 88.14
C00049580 Lobatin D
(-)-Lobatin D		 88.14
C00049590 Neurolenin G 88.14
C00013007 Inucrithmolide
[3R-[3alpha,3abeta,5alpha,5aalpha,6beta(Z),9aalpha,9bbeta]]-5-(Acetyloxy)-2,3,3a,4,5,5a,6,7,9a,9b-decahydro-3,5a,9-trimethyl-2-oxonaphtho[1,2-b]furan-6-yl ester 2-methyl-2-butenoic acid		 87.93
C00023177 Eupalinilide A 87.93
C00012192 [3aR-[3aR*,4R*(E),6E,10E,11aR*]]-2,3,3a,4,5,8,9,11a-Octahydro-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 2-[(acetyloxy)methyl]-2-butenoic acid 87.72
C00012320 (+)-Lychnostatin 2
Lychnostatin 2		 87.72
C00043498 Eupachinilide G
(-)-Eupachinilide G		 87.72
C00003342 Orizabin 87.50
C00012104 Eupassopilin 87.50
C00012976 (+)-Tirotundifolin C
Tirotundifolin C
(3aR,4R,5aR,6R,9aS,9bR)-[partial]- 2,3,3a,4,5,5a,6,7,9a,9b-Decahydro-6-hydroxy-5a,9-dimethyl-3-methylene-2-oxonaphtho[1,2-b]furan-4-yl ester 3-hydroxy-2-methylenebutanoic acid		 87.50
C00020525 9beta-Hydroxy-8beta-tiglinoyloxy-lasiolaenin 87.50
C00020565 5-Desoxypumilim 87.50
C00020598 Eupasessifolide A 87.50
C00020788 Eupahakonenin A 87.50
C00020794 [3aR-[3aalpha,4beta(E),6aalpha,9aalpha,9bbeta]]-2,3,3a,4,5,6,6a,7,9a,9b-Decahydro-9-methyl-3,6-bis(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester 4-hydroxy-2-methyl-2-butenoic acid 87.50
C00020795 [3aR-[3aalpha,4beta(R*),6aalpha,9aalpha,9bbeta]]-2,3,3a,4,5,6,6a,7,9a,9b-Decahydro-9-methyl-3,6-bis(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester 2,5-dihydro-5-hydroxy-3-furancarboxylic acid 87.50
C00020815 Shairidin 87.50
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 87.50
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		 87.50
C00020878 Pumilin 87.50
C00020880 5-Hydroxyeupasessifolide B 87.50
C00022429 Rupestralic acid 87.50
C00023178 Eupalinilide B 87.50
C00023181 Eupalinilide E 87.50
C00033605 9alpha-Acetoxycumambrin A
(+)-9alpha-Acetoxycumambrin A		 87.50
C00041460 Crassocolide F
(+)-Crassocolide F		 87.50
C00043494 Eupachinilide A
(-)-Eupachinilide A		 87.50
C00046558 13-Acetoxysarcocrassolide
(+)-13-Acetoxysarcocrassolide		 87.50
C00020564 Skutchiolide B 87.30
C00012227 5-(Acetyloxy)-2,3,3a,4,5,8,9,11a-octahydro-6,10-bis(hydroxymethyl)-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 2-methylbutanoic acid 86.89
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