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521-13-1

521-13-1 structural image
Product Name: 3beta-Hydroxy-5-cholestene 3-butyrate
Formula: C31H52O2
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COMPUTED DESCRIPTORS

Molecular Weight 456.7 g/mol
XLogP3 9.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 9
Exact Mass 456.396730897 g/mol
Monoisotopic Mass 456.396730897 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 722
Isotope Atom Count 0
Defined Atom Stereocenter Count 8
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes