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566-42-7

566-42-7 structural image
Product Name: 5-BETA-PREGNAN-17,21-DIOL-3,20-DIONE
Formula: C21H32O4
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COMPUTED DESCRIPTORS

Molecular Weight 348.5 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 348.23005950 g/mol
Monoisotopic Mass 348.23005950 g/mol
Topological Polar Surface Area 74.6 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 601
Isotope Atom Count 0
Defined Atom Stereocenter Count 7
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes