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86629-72-3

86629-72-3 structural image
Product Name: 4a-Hydroxyavermectin B1
Formula: C48H72O15
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COMPUTED DESCRIPTORS

Molecular Weight 889.1 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 15
Rotatable Bond Count 9
Exact Mass 888.48712159 g/mol
Monoisotopic Mass 888.48712159 g/mol
Topological Polar Surface Area 190 Ų
Heavy Atom Count 63
Formal Charge 0
Complexity 1740
Isotope Atom Count 0
Defined Atom Stereocenter Count 20
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 3
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes