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119979-33-8

119979-33-8 structural image
Product Name: helvecardin A
Formula: C90H103Cl2N9O36
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COMPUTED DESCRIPTORS

Molecular Weight 1957.7 g/mol
XLogP3 -3.5
Hydrogen Bond Donor Count 25
Hydrogen Bond Acceptor Count 39
Rotatable Bond Count 19
Exact Mass 1955.5882760 g/mol
Monoisotopic Mass 1955.5882760 g/mol
Topological Polar Surface Area 699 Ų
Heavy Atom Count 137
Formal Charge 0
Complexity 4040
Isotope Atom Count 0
Defined Atom Stereocenter Count 19
Undefined Atom Stereocenter Count 13
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes