4-demethyl-6-O-methyldoxorubicin
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4-demethyl-6-O-methyldoxorubicin
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CAS No:
97777-78-1
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Formula:
C27H29NO11
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Chemical Name:
4-demethyl-6-O-methyldoxorubicin
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Synonyms:
4-demethyl-6-O-methyldoxorubicin;5,12-Naphthacenedione, 10-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-1,6,8-trihydroxy-8-(hydroxyacetyl)-11-methoxy-, (8S-cis)-;5,12-Naphthacenedione, 10-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-8-(hydroxyacetyl)-7,8,9,10-tetrahydro-11-methoxy-1,6,8-trihydroxy-;2,5,10-trihydroxy-2-(hydroxyacetyl)-12-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxyhexopyranoside;CTK3I8112;DTXSID10913657;LS-93991;10-(4-amino-5-hydroxy-6-methyl-oxan-2-yl)oxy-1,6,9-trihydroxy-9-(2-hydroxyacetyl)-11-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
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CAS No:
Computed Properties
Molecular Weight:543.5
XLogP3:1.3
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:5
Exact Mass:543.17406074
Monoisotopic Mass:543.17406074
Topological Polar Surface Area:206
Heavy Atom Count:39
Complexity:977
Undefined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4-demethyl-6-O-methyldoxorubicin
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