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190513-83-8

190513-83-8 structural image
Product Name: 4-O-BENZYL-3-(-)-CARBOXYMENTHYL-1,2:5,6-DI-O-CYCLOHEXYLIDENE-L-MYO-INOSITOL
Formula: C36H52O8
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COMPUTED DESCRIPTORS

Molecular Weight 612.8 g/mol
XLogP3 7.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 8
Exact Mass 612.36621861 g/mol
Monoisotopic Mass 612.36621861 g/mol
Topological Polar Surface Area 81.7 Ų
Heavy Atom Count 44
Formal Charge 0
Complexity 967
Isotope Atom Count 0
Defined Atom Stereocenter Count 9
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes