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1260252-18-3

1260252-18-3 structural image
Product Name: 1→4-β-oleandropyranosyl-11-O-isobutyryl-12-O-acetyltenacigenin B
Formula: C41H64O14
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COMPUTED DESCRIPTORS

Molecular Weight 780.9 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 14
Rotatable Bond Count 12
Exact Mass 780.42960671 g/mol
Monoisotopic Mass 780.42960671 g/mol
Topological Polar Surface Area 178 Ų
Heavy Atom Count 55
Formal Charge 0
Complexity 1470
Isotope Atom Count 0
Defined Atom Stereocenter Count 19
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes