Cas no 55729-18-5 (Lilioside A)

Lilioside A structure
Lilioside A structure
Product Name:Lilioside A
CAS No:55729-18-5
MF:C11H20O9
MW:296.271104812622
CID:2072758
Update Time:2025-04-21

Lilioside A Chemical and Physical Properties

Names and Identifiers

    • Lilioside A
    • 2-Acetoxy-1-(hydroxymethyl)ethyl β-D-glucopyranoside
    • Inchi: 1S/C11H20O9/c1-5(14)18-4-6(2-12)19-11-10(17)9(16)8(15)7(3-13)20-11/h6-13,15-17H,2-4H2,1H3
    • InChI Key: WOXRFOGJAFXBAH-UHFFFAOYSA-N
    • SMILES: CC(OCC(OC1C(O)C(O)C(O)C(CO)O1)CO)=O

Computed Properties

  • Exact Mass: 296.111
  • Monoisotopic Mass: 296.111
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 9
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 7
  • Complexity: 310
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 5
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 146A^2
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