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77734-91-9

77734-91-9 structural image
Product Name: PALYTOXIN
Formula: C129H223N3O54
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COMPUTED DESCRIPTORS

Molecular Weight 2680.1 g/mol
XLogP3 -6.6
Hydrogen Bond Donor Count 45
Hydrogen Bond Acceptor Count 55
Rotatable Bond Count 80
Exact Mass 2679.4829484 g/mol
Monoisotopic Mass 2678.4795936 g/mol
Topological Polar Surface Area 1030 Ų
Heavy Atom Count 186
Formal Charge 0
Complexity 5250
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 64
Defined Bond Stereocenter Count 7
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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