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20704-80-7

20704-80-7 structural image
Product Name: riboflavin-5'-monobutyrate
Formula: C21H26N4O7
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COMPUTED DESCRIPTORS

Molecular Weight 446.5 g/mol
XLogP3 -0.1
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 9
Exact Mass 446.18014918 g/mol
Monoisotopic Mass 446.18014918 g/mol
Topological Polar Surface Area 161 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 814
Isotope Atom Count 0
Defined Atom Stereocenter Count 3
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes