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956376-54-8

956376-54-8 structural image
Product Name: (S)-2-(3-(7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)propanamido)propanoic acid
Formula: C16H17NO6
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COMPUTED DESCRIPTORS

Molecular Weight 319.31 g/mol
XLogP3 1
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 319.10558726 g/mol
Monoisotopic Mass 319.10558726 g/mol
Topological Polar Surface Area 113 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 541
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes