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Homecas79162-16-6

79162-16-6

79162-16-6 structural image
Product Name: Justicisaponin I
Formula: C46H66O11
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COMPUTED DESCRIPTORS

Molecular Weight 795.0 g/mol
XLogP3 7.6
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 9
Exact Mass 794.46051292 g/mol
Monoisotopic Mass 794.46051292 g/mol
Topological Polar Surface Area 172 Ų
Heavy Atom Count 57
Formal Charge 0
Complexity 1590
Isotope Atom Count 0
Defined Atom Stereocenter Count 12
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes