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11031-38-2

11031-38-2 structural image
Product Name: rubradirin
Formula: C48H46N4O20
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COMPUTED DESCRIPTORS

Molecular Weight 998.9 g/mol
XLogP3 4.9
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 22
Rotatable Bond Count 9
Exact Mass 998.27053987 g/mol
Monoisotopic Mass 998.27053987 g/mol
Topological Polar Surface Area 348 Ų
Heavy Atom Count 72
Formal Charge 0
Complexity 2380
Isotope Atom Count 0
Defined Atom Stereocenter Count 8
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes