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111466-29-6

111466-29-6 structural image
Product Name: 8,14-Methano-2H,14H-1-benzopyrano[7,8-d][1,3]benzodioxocin-3,5,11,13,15-pentol,2,8-bis(3,4-dihydroxyphenyl)-3,4-dihydro-, (2S,3R,8S,14R,15R)-
Formula: C30H24O12
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COMPUTED DESCRIPTORS

Molecular Weight 592.5 g/mol
XLogP3 2
Hydrogen Bond Donor Count 10
Hydrogen Bond Acceptor Count 13
Rotatable Bond Count 2
Exact Mass 592.12169082 g/mol
Monoisotopic Mass 592.12169082 g/mol
Topological Polar Surface Area 230 Ų
Heavy Atom Count 43
Formal Charge 0
Complexity 1010
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 5
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes