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Homecas121368-52-3

121368-52-3

121368-52-3 structural image
Product Name: Bernardioside A
Formula: C36H58O11
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COMPUTED DESCRIPTORS

Molecular Weight 666.8 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 8
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 5
Exact Mass 666.39791266 g/mol
Monoisotopic Mass 666.39791266 g/mol
Topological Polar Surface Area 197 Ų
Heavy Atom Count 47
Formal Charge 0
Complexity 1270
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