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82628-87-3

82628-87-3 structural image
Product Name: 4'-O-(-D-2”,3”,4”,6”-TETRAACETYL-GLUCOPYRANOSYL)-4-NITROPHLORETIN
Formula: C29H31NO15
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COMPUTED DESCRIPTORS

Molecular Weight 633.6 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 15
Rotatable Bond Count 15
Exact Mass 633.16936928 g/mol
Monoisotopic Mass 633.16936928 g/mol
Topological Polar Surface Area 227 Ų
Heavy Atom Count 45
Formal Charge 0
Complexity 1070
Isotope Atom Count 0
Defined Atom Stereocenter Count 5
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes