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956931-61-6

956931-61-6 structural image
Product Name: (3aR,8aR,9aR)-3-[[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-5,8a-dimethyl-3,3a,4,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-2-one
Formula: C27H37NO4
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COMPUTED DESCRIPTORS

Molecular Weight 439.6 g/mol
XLogP3 4.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 439.27225866 g/mol
Monoisotopic Mass 439.27225866 g/mol
Topological Polar Surface Area 48 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 765
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes