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126266-38-4

126266-38-4 structural image
Product Name: Benzoylmesaconine hydrochloride
Formula: C31H46ClNO11
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COMPUTED DESCRIPTORS

Molecular Weight 644.1 g/mol
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 8
Exact Mass 643.2759390 g/mol
Monoisotopic Mass 643.2759390 g/mol
Topological Polar Surface Area 148 Ų
Heavy Atom Count 44
Formal Charge 0
Complexity 1100
Isotope Atom Count 0
Defined Atom Stereocenter Count 13
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 3
Compound Is Canonicalized Yes