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36824-93-8

36824-93-8 structural image
Product Name: Lacto-N-neohexaose
Formula: C40H68N2O31
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COMPUTED DESCRIPTORS

Molecular Weight 1073.0 g/mol
XLogP3 -12
Hydrogen Bond Donor Count 20
Hydrogen Bond Acceptor Count 31
Rotatable Bond Count 23
Exact Mass 1072.38060337 g/mol
Monoisotopic Mass 1072.38060337 g/mol
Topological Polar Surface Area 532 Ų
Heavy Atom Count 73
Formal Charge 0
Complexity 1730
Isotope Atom Count 0
Defined Atom Stereocenter Count 21
Undefined Atom Stereocenter Count 8
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes