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886441-74-3

886441-74-3 structural image
Product Name: Benzo[3,4]cycloocta[1,2-f][1,3]benzodioxole-1,8-diol, 5,6,7,8-tetrahydro-2,3,13-trimethoxy-6,7-dimethyl-, 8-benzoate, (6R,7R,8R,13aR)- (9CI)
Formula: C29H30O8
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COMPUTED DESCRIPTORS

Molecular Weight 506.5 g/mol
XLogP3 5.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 6
Exact Mass 506.19406791 g/mol
Monoisotopic Mass 506.19406791 g/mol
Topological Polar Surface Area 92.7 Ų
Heavy Atom Count 37
Formal Charge 0
Complexity 771
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