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116457-99-9

116457-99-9 structural image
Product Name: 1-PALMITYLTHIO-2-PALMITOYLAMIDO-1,2-DIDEOXY-SN-GLYCERO-3-PHOSPHOCHOLINE
Formula: C45H93N2O4PS
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COMPUTED DESCRIPTORS

Molecular Weight 736.1 g/mol
XLogP3 14.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 39
Exact Mass 735.58385696 g/mol
Monoisotopic Mass 735.58385696 g/mol
Topological Polar Surface Area 110 Ų
Heavy Atom Count 49
Formal Charge 1
Complexity 767
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes