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  • [Synonyms]
    Morellin
    NSC30554

    [Structure]

    [ Properties Computed from Structure]
    Molecular Weight546.65062 [g/mol]
    Molecular FormulaC33H38O7
    XLogP4.9
    H-Bond Donor1
    H-Bond Acceptor7
    Rotatable Bond Count7
    Tautomer Count129
    Exact Mass546.261754
    MonoIsotopic Mass546.261754
    Topological Polar Surface Area99.1
    Heavy Atom Count40
    Formal Charge0
    Complexity1200
    Isotope Atom Count0
    Defined Atom StereoCenter Count0
    Undefined Atom StereoCenter Count3
    Defined Bond StereoCenter Count0
    Undefined Bond StereoCenter Count0
    Covalently-Bonded Unit Count1

    [ Descriptors Computed from Structure]



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