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20231-57-6

20231-57-6 structural image
Product Name: 3β-Hydroxychol-5-enoic Acid Methyl Ester
Formula: C25H40O3
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COMPUTED DESCRIPTORS

Molecular Weight 388.6 g/mol
XLogP3 5.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 5
Exact Mass 388.29774513 g/mol
Monoisotopic Mass 388.29774513 g/mol
Topological Polar Surface Area 46.5 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 640
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