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


and

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




INPUT WORD = C00012868 , 50% or more
[ Metabolite Name : 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 ]
Number of matched data : 57

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00020511 Aguerin A 98.00
C00020512 Aguerin B 98.00
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		 96.08
C00003243 Cynaropicrin 94.23
C00003366 Saupirin
sauparine		 94.23
C00011887 Tagitinin D
Tirotundin		 94.23
C00020735 Repdiolide 94.23
C00011981 Zinarosin 94.12
C00029909 Carlaolide A
(-)-Carlaolide A		 94.12
C00034536 Hierapolitanin A
(+)-Hierapolitanin A		 94.12
C00012330 Subcordatolide D 94.00
C00033595 8alpha-Isobutyryloxydouglanin 94.00
C00020594 19-Deoxyjanerin
Desoxyrepin		 92.45
C00033836 Estafiatin 8-O-isovalerate 92.45
C00011865 Erioflorin 92.31
C00012113 Zexbrevin 92.31
C00012867 beta-Cyclotanacin
Chrysanin
Taxillin
[3aR-[3aalpha,4alpha(Z),4aalpha,8beta,8abeta,9abeta]]-Dodecahydro-8-hydroxy-8a-methyl-3,5-bis(methylene)-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid		 92.31
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		 92.31
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		 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
C00003208 Alatolide 92.16
C00003339 Nobilin 92.16
C00011756 Millefin 92.16
C00011816 8beta-(2-Methylbutanoyl)-14-hydroxy-1(10),4E,11(13)-germacratrien-12,6beta-olide 92.16
C00011843 (+)-Caleine E
Calein E		 92.16
C00011848 1(10)E-Millerenolide 92.16
C00011856 Tagitinin C 92.16
C00011857 Vernopectolide B 92.16
C00011977 Isoarbutifolin 92.16
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 92.16
C00011983 [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 92.16
C00012056 Zinaflavin G 92.16
C00012849 Decahydro-alpha,4a-dimethyl-8-methylene-7-(2-methyl-1-oxopropoxy)-2-naphthaleneacetic acid 92.00
C00012869 Dihydro-beta-cyclopyrethrosin
[3R-(3alpha,3aalpha,4alpha,4aalpha,8beta,8abeta,9abeta)]-4-(Acetyloxy)decahydro-8-hydroxy-3,8a-dimethyl-5-methylene-naphtho[2,3-b]furan-2(3H)-one		 92.00
C00017308 NSC 302301 92.00
C00049965 8beta-Isobutyryloxycumambranolide
(-)-8beta-Isobutyryloxycumambranolide		 92.00
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 90.74
C00012154 Tagitinin A 90.74
C00012956 Tanapsin
[3aR-[3aalpha,4alpha(Z),4aalpha,5beta,8beta,8abeta,9abeta]]-Dodecahydro-5,8-dihydroxy-5,8a-dimethyl-3-methylene-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid		 90.74
C00020443 Linichlorin A
Elegin
19-Desoxychlorojanerin		 90.74
C00020505 Epicentaurepensin
Linichlorin B		 90.74
C00020850 Acrorepiolide 90.74
C00003257 Eremantholide A 90.57
C00011847 Eupachifolin A 90.57
C00012300 Resinosolide 90.57
C00012399 Zinangustolide 90.57
C00012404 Eremantholide C 90.57
C00003370 Tagitinin F 90.38
C00011866 Tagitinin E 90.38
C00012115 Ciliarin 90.38
C00012117 15-Deoxygayazensolide 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
C00020513 Dehydrocyanaropicrin 90.38
C00020858 Subcordatolide A 90.38
C00049404 Tomenphantin A 90.38
C00049405 Tomenphantin B 90.38
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