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16727-02-9

16727-02-9 structural image
Product Name: CYANIDIN 3-SOPHOROSIDE-5-GLUCOSIDE
Formula: C33H41ClO21
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COMPUTED DESCRIPTORS

Molecular Weight 779.1 g/mol
Hydrogen Bond Donor Count 13
Hydrogen Bond Acceptor Count 20
Rotatable Bond Count 9
Exact Mass 778.1723213 g/mol
Monoisotopic Mass 778.1723213 g/mol
Topological Polar Surface Area 319 Ų
Heavy Atom Count 53
Formal Charge 0
Complexity 1140
Isotope Atom Count 0
Defined Atom Stereocenter Count 14
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes