1,8,10-trihydroxy-6-methyl-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-(4,5,9-trihydroxy-2-methyl-10-oxoanthracen-9-yl)anthracen-9-one
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1,8,10-trihydroxy-6-methyl-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-(4,5,9-trihydroxy-2-methyl-10-oxoanthracen-9-yl)anthracen-9-one
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CAS No:
120163-26-0
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Formula:
C36H32O13
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Chemical Name:
1,8,10-trihydroxy-6-methyl-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-(4,5,9-trihydroxy-2-methyl-10-oxoanthracen-9-yl)anthracen-9-one
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Synonyms:
Ramosin;NSC628050;120163-26-0;Hexitol, 1,5-anhydro-1-C-(9,9',10,10'-tetrahydro-1,4',5',8,9',10-hexahydroxy-2',6-dimethyl-9,10'-dioxo[2,9'-bianthracen]-10-yl)-;CHEMBL1987571;DTXSID50923250;NSC-628050;1,8,10-trihydroxy-6-methyl-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-(4,5,9-trihydroxy-2-methyl-10-oxoanthracen-9-yl)anthracen-9-one;NCI60_009021;1,5-Anhydro-1-(1,4',5',8,9',10-hexahydroxy-2',6-dimethyl-9,10'-dioxo-9,9',10,10'-tetrahydro[2,9'-bianthracen]-10-yl)hexitol;1,8,10-trihydroxy-6-methyl-10-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]-2-(4,5,9-trihydroxy-2-methyl-10-oxo-9-anthryl)anthracen-9-one
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CAS No:
1,8,10-trihydroxy-6-methyl-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2-(4,5,9-trihydroxy-2-methyl-10-oxoanthracen-9-yl)anthracen-9-one Basic Attributes
672.6 g/mol
672.18429107 g/mol
628050
Computed Properties
Molecular Weight:672.6
XLogP3:2.1
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:3
Exact Mass:672.18429107
Monoisotopic Mass:672.18429107
Topological Polar Surface Area:246
Heavy Atom Count:49
Complexity:1280
Undefined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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