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252042-59-4

252042-59-4 structural image
Product Name: 3d-(6-Acyl) phad
Formula: C96H181N2O21P
Synonyms: Monophosphoryl Hexa-acyl Lipid A, 3-Deacyl (Synthetic)
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COMPUTED DESCRIPTORS

Molecular Weight 1730.4 g/mol
XLogP3 29.1
Hydrogen Bond Donor Count 8
Hydrogen Bond Acceptor Count 21
Rotatable Bond Count 92
Exact Mass 1730.29280262 g/mol
Monoisotopic Mass 1729.28944778 g/mol
Topological Polar Surface Area 347 Ų
Heavy Atom Count 120
Formal Charge 0
Complexity 2500
Isotope Atom Count 0
Defined Atom Stereocenter Count 12
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes