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11018-93-2

11018-93-2 structural image
Product Name: THEVETIN
Formula: C42H66O18
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COMPUTED DESCRIPTORS

Molecular Weight 859.0 g/mol
XLogP3 -1.6
Hydrogen Bond Donor Count 9
Hydrogen Bond Acceptor Count 18
Rotatable Bond Count 10
Exact Mass 858.42491525 g/mol
Monoisotopic Mass 858.42491525 g/mol
Topological Polar Surface Area 273 Ų
Heavy Atom Count 60
Formal Charge 0
Complexity 1570
Isotope Atom Count 0
Defined Atom Stereocenter Count 22
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes