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Homecas222310-82-9

222310-82-9

222310-82-9 structural image
Product Name: Carbonate ionophore VII
Formula: C58H79F6NO7
Synonyms: N,N-Dioctyl-3α,12α-bis(4-trifluoroacetylbenzoyloxy)-5β-cholan-24-amide
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COMPUTED DESCRIPTORS

Molecular Weight 1016.2 g/mol
XLogP3 17.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 13
Rotatable Bond Count 26
Exact Mass 1015.57607283 g/mol
Monoisotopic Mass 1015.57607283 g/mol
Topological Polar Surface Area 107 Ų
Heavy Atom Count 72
Formal Charge 0
Complexity 1770
Isotope Atom Count 0
Defined Atom Stereocenter Count 10
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes