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


and

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




INPUT WORD = C00011983 , 50% or more
[ Metabolite Name : [3aS-(3aalpha,4beta,5beta,6alpha,7alpha,7abeta)]-6-Ethenyl-5-(1-formylethenyl)octahydro-4-hydroxy-6-methyl-3-methylene-2-oxo-7-benzofuranyl ester 2-methyl-2-propenoic acid ]
Number of matched data : 52

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012056 Zinaflavin G 100.00
C00011981 Zinarosin 98.04
C00012057 Zinaflavin H 96.23
C00011982 [3aS-(3aalpha,4beta,5beta,6alpha,7abataethenyl-5-(1-formylethenyl)octahydro-7-hydroxy-6-methyl-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-propenoic acid 96.08
C00011991 [3aS-[3aalpha,4beta,5beta,6alpha(S*),7alpha,7abeta]]-5-(1-Formylethenyl)octahydro-4-hydroxy-6-methyl-3-methylene-6-oxiranyl-2-oxo-7-benzofuranyl ester 2-methyl-2-propenoic acid 94.44
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 94.34
C00011848 1(10)E-Millerenolide 94.12
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		 94.12
C00011989 [3aS-[3aalpha,4beta,5beta,6alpha(S*),7alpha,7abeta]]-5-(1-Formylethenyl)octahydro-7-hydroxy-6-methyl-3-methylene-6-oxiranyl-2-oxo-4-benzofuranyl ester 2-methyl-2-propenoic acid 92.59
C00012028 Zinaflavin A 92.59
C00012399 Zinangustolide 92.45
C00003360 Radiatin 92.31
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		 92.31
C00030468 Hemistepsin 92.31
C00049404 Tomenphantin A 92.31
C00049405 Tomenphantin B 92.31
C00012868 Subcordatolide C
[3aR-(3aalpha,4alpha,4aalpha,8beta,8abeta,9aalpha)]-Dodecahydro-8-hydroxy-8a-methyl-3,5-bis(methylene)-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-propanoic acid		 92.16
C00034536 Hierapolitanin A
(+)-Hierapolitanin A		 92.16
C00011996 Zempoalin C 90.91
C00012060 Verafinin C 90.91
C00013213 [3aS-(3aalpha,4alpha,4abeta,6alpha,9alpha,9aalpha,10beta,10aalpha)]-Dodecahydro-10-hydroxy-9a-methyl-3,5-bis(methylene)-2-oxo-6,9-epoxyfuro[2,3-h][3]benzoxepin-4-yl ester 2-methyl-2-propenoic acid 90.91
C00012027 (+)-Zinaflavin B
Zinaflavin B		 90.74
C00011980 Schkuhridin A 90.57
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 90.57
C00011992 Zinaflorin V 90.57
C00011887 Tagitinin D
Tirotundin		 90.38
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		 90.38
C00020735 Repdiolide 90.38
C00020858 Subcordatolide A 90.38
C00044993 Pachyclavulariolide Q
(+)-Pachyclavulariolide Q		 90.38
C00003208 Alatolide 90.20
C00003333 Molephantin 90.20
C00011843 (+)-Caleine E
Calein E		 90.20
C00011849 9E-Millerenolide 90.20
C00011852 Acantholide 90.20
C00011977 Isoarbutifolin 90.20
C00012261 Leucanthanolide 90.20
C00012299 Arcotiopicrin
Orientin (sesquiterpene)		 90.20
C00012339 Gochnatolide 90.20
C00020511 Aguerin A 90.20
C00020512 Aguerin B 90.20
C00011988 [3aS-[3aalpha,4beta,5beta,6alpha(S*),7alpha(Z),7abeta]]-5-(1-Formylethenyl)octahydro-4-hydroxy-6-methyl-3-methylene-6-oxiranyl-2-oxo-7-benzofuranyl ester 2-methyl-2-butenoic acid 89.29
C00003384 Vernodalin 88.89
C00011765 Melampodin C 88.89
C00012055 (+)-Elemacarmanin
Elemacarmanin		 88.89
C00012053 [3aS-[3aalpha,4alpha,5beta(Z),6beta,7alpha,7aalpha]]-6-Ethenyloctahydro-3a,4-dihydroxy-6-methyl-3-methylene-7-(1-methylethenyl)-2-oxo-5-benzofuranyl ester 2-methyl-2-butenoic acid 88.68
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 88.68
C00012341 Ineupatorolide A 88.68
C00012342 Ineupatorolide B
Nepalolide C		 88.68
C00020594 19-Deoxyjanerin
Desoxyrepin		 88.68
C00040311 Sinulaflexiolide D
(+)-Sinulaflexiolide D		 88.68
C00049579 Desacetyl-neurolenin G
(-)-Desacetyl-neurolenin G		 88.68
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