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Homecas57944-18-0

57944-18-0

57944-18-0 structural image
Product Name: Officinalisinin I
Formula: C45H76O19
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COMPUTED DESCRIPTORS

Molecular Weight 921.1 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 12
Hydrogen Bond Acceptor Count 19
Rotatable Bond Count 13
Exact Mass 920.49808019 g/mol
Monoisotopic Mass 920.49808019 g/mol
Topological Polar Surface Area 307 Ų
Heavy Atom Count 64
Formal Charge 0
Complexity 1560
Isotope Atom Count 0
Defined Atom Stereocenter Count 26
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes