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108321-31-9

108321-31-9 structural image
Product Name: α-Nicotinamide adenine dinucleotide
Formula: C21H30N7NaO14P2
Synonyms: α-Dihydrodiphosphopyridine nucleotide;α-Dihydronicotinamide adenine dinucleotide;α-DPNH;α-NADH
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COMPUTED DESCRIPTORS

Molecular Weight 709.4 g/mol
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 19
Rotatable Bond Count 11
Exact Mass 709.08866112 g/mol
Monoisotopic Mass 709.08866112 g/mol
Topological Polar Surface Area 323 Ų
Heavy Atom Count 46
Formal Charge 0
Complexity 1210
Isotope Atom Count 0
Defined Atom Stereocenter Count 8
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 3
Compound Is Canonicalized Yes