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


and

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





INPUT WORD = C00020512 , 50% or more
[ Metabolite Name : Aguerin B ]
Number of matched data : 62

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00020511 Aguerin A 100.00
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
98.00
C00003243 Cynaropicrin 96.15
C00003366 Saupirin
sauparine
96.15
C00020735 Repdiolide 96.15
C00029909 Carlaolide A
(-)-Carlaolide A
96.08
C00020594 19-Deoxyjanerin
Desoxyrepin
94.34
C00033836 Estafiatin 8-O-isovalerate 94.34
C00011887 Tagitinin D
Tirotundin
94.23
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
C00034536 Hierapolitanin A
(+)-Hierapolitanin A
94.12
C00012330 Subcordatolide D 94.00
C00049965 8beta-Isobutyryloxycumambranolide
(-)-8beta-Isobutyryloxycumambranolide
94.00
C00020443 Linichlorin A
Elegin
19-Desoxychlorojanerin
92.59
C00020505 Epicentaurepensin
Linichlorin B
92.59
C00020850 Acrorepiolide 92.59
C00011865 Erioflorin 92.31
C00012113 Zexbrevin 92.31
C00020513 Dehydrocyanaropicrin 92.31
C00020858 Subcordatolide A 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
C00011981 Zinarosin 92.16
C00020623 [3aS-(3aalpha,7alpha,7abeta,8abeta,8balpha,8cbeta)]-2,3,3a,4,5,7,7a,8a,8b,8c-Decahydro-6,8a-dimethyl-3-methylene-2-oxooxireno[2,3]azuleno[4,5-b]furan-7-yl ester 2-methyl-2-propenoic acid 92.16
C00003392 Viscidulin B 92.00
C00020587 Arteglasin B 92.00
C00020798 Subexpinnatin 92.00
C00020800 Vernudifloride 92.00
C00033595 8alpha-Isobutyryloxydouglanin 92.00
C00045462 Zaluzanin C isobutyrate
(+)-Zaluzanin C isobutyrate
92.00
C00020595 Janerin 90.91
C00020736 Epoxyrepdiolide 90.91
C00012154 Tagitinin A 90.74
C00035782 15-O-Isovaleroyl-2alpha-hydroxyamphoricarpolide 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
C00033835 Estafiatin 8-O-angelate 90.57
C00003370 Tagitinin F 90.38
C00011866 Tagitinin E 90.38
C00012115 Ciliarin 90.38
C00012117 15-Deoxygayazensolide 90.38
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
90.38
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
90.38
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
90.38
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
90.38
C00020479 Angeloylcumambrin B 90.38
C00020506 8alpha-Acetoxyzaluzanin D 90.38
C00021161 Desacetyltetraneurin D 15-O-isobutyrate 90.38
C00038458 Annuolide F 90.38
C00049404 Tomenphantin A 90.38
C00049405 Tomenphantin B 90.38
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