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449733-84-0

449733-84-0 structural image
Product Name: Specneuzhenide
Formula: C31H42O17
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COMPUTED DESCRIPTORS

Molecular Weight 686.7 g/mol
XLogP3 -2.2
Hydrogen Bond Donor Count 8
Hydrogen Bond Acceptor Count 17
Rotatable Bond Count 14
Exact Mass 686.24219987 g/mol
Monoisotopic Mass 686.24219987 g/mol
Topological Polar Surface Area 261 Ų
Heavy Atom Count 48
Formal Charge 0
Complexity 1120
Isotope Atom Count 0
Defined Atom Stereocenter Count 12
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes