methyl 5,7-dichloro-4',6-dihydroxy-5'-methoxy-4-methyl-3,3'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate
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![methyl 5,7-dichloro-4',6-dihydroxy-5'-methoxy-4-methyl-3,3'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/7b0fd6534aac441e9458fa8050261bfe.png "methyl 5,7-dichloro-4',6-dihydroxy-5'-methoxy-4-methyl-3,3'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate")
methyl 5,7-dichloro-4',6-dihydroxy-5'-methoxy-4-methyl-3,3'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate
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CAS No:
94663-91-9
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Formula:
C17H12Cl2O8
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Chemical Name:
methyl 5,7-dichloro-4',6-dihydroxy-5'-methoxy-4-methyl-3,3'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate
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Synonyms:
Gillusdin; 5,7-Dichloro-5',6'-dihydroxy-6'-methoxy-4-methyl-3,4-dioxospiro(benzofuran-2(3H)-1'-(2,5)-cyclohexadiene)-2-carboxylic acid methyl ester; Spiro(benzofuran-2(3H),1'-(2,5)cyclohexadiene)-2'-carboxylic acid,5,7-dichloro-5',6-dihydroxy-6'-methoxy-4-methyl-3,4'-dioxo-,methyl ester;
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CAS No:
methyl 5,7-dichloro-4',6-dihydroxy-5'-methoxy-4-methyl-3,3'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate Basic Attributes
415.17800
413.9909227 g/mol
Drug Information
5,7-dichloro-5',6'-dihydroxy-6'-methoxy-4-methyl-3,4-dioxospiro(benzofuran-2(3H)-1'-(2,5)-cyclohexadiene)-2-carboxylic acid methyl ester
Computed Properties
Molecular Weight:415.2
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:3
Exact Mass:413.9909227
Monoisotopic Mass:413.9909227
Topological Polar Surface Area:119
Heavy Atom Count:27
Complexity:775
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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