4-demethoxydoxorubicinone
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4-demethoxydoxorubicinone
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CAS No:
86333-80-4
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Formula:
C20H16O8
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Chemical Name:
4-demethoxydoxorubicinone
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Synonyms:
4-demethoxyadriamycinone;4-demethoxydoxorubicinone;(7S-cis)-7,8,9,10-Tetrahydro-6,7,9,11-tetrahydroxy-9-(hydroxyacetyl)-5,12-naphthacenedione;DTXSID101006715;(7S,9S)-6,7,9,11-tetrahydroxy-9-(2-hydroxyacetyl)-8,10-dihydro-7H-tetracene-5,12-dione;6,7,9,11-Tetrahydroxy-9-(hydroxyacetyl)-7,8,9,10-tetrahydrotetracene-5,12-dione;5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,7,9,11-tetrahydroxy-9-(hydroxyacetyl)-, (7S-cis)-
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CAS No:
Computed Properties
Molecular Weight:384.3
XLogP3:1.6
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:2
Exact Mass:384.08451746
Monoisotopic Mass:384.08451746
Topological Polar Surface Area:152
Heavy Atom Count:28
Complexity:692
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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