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113665-89-7

113665-89-7 structural image
Product Name: 8,9-Z-AVERMECTINB1A
Formula: C48H72O14
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COMPUTED DESCRIPTORS

Molecular Weight 873.1 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 14
Rotatable Bond Count 8
Exact Mass 872.49220697 g/mol
Monoisotopic Mass 872.49220697 g/mol
Topological Polar Surface Area 170 Ų
Heavy Atom Count 62
Formal Charge 0
Complexity 1730
Isotope Atom Count 0
Defined Atom Stereocenter Count 9
Undefined Atom Stereocenter Count 11
Defined Bond Stereocenter Count 3
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes