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Homecas2270232-93-2

2270232-93-2

2270232-93-2 structural image
Product Name: Obeticholic acid 3-O-β-D-glucuronide
Formula: C32H52O10
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COMPUTED DESCRIPTORS

Molecular Weight 596.7 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 8
Exact Mass 596.35604785 g/mol
Monoisotopic Mass 596.35604785 g/mol
Topological Polar Surface Area 174 Ų
Heavy Atom Count 42
Formal Charge 0
Complexity 1010
Isotope Atom Count 0
Defined Atom Stereocenter Count 16
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes