Cas no 99663-29-3 (7-oxo-7H-furo[3,2-g]chromen-9-yl beta-D-glucopyranoside)

7-oxo-7H-furo[3,2-g]chromen-9-yl beta-D-glucopyranoside structure
99663-29-3 structure
Product Name:7-oxo-7H-furo[3,2-g]chromen-9-yl beta-D-glucopyranoside
CAS No:99663-29-3
MF:C17H16O9
MW:364.303545951843
CID:1992596
PubChem ID:188627
Update Time:2024-03-01

7-oxo-7H-furo[3,2-g]chromen-9-yl beta-D-glucopyranoside Chemical and Physical Properties

Names and Identifiers

    • 7-oxo-7H-furo[3,2-g]chromen-9-yl beta-D-glucopyranoside
    • 7H-Furo[3,2-g][1]benzopyran-7-one, 9-(β-D-glucopyranosyloxy)-
    • 99663-29-3
    • DTXSID60912559
    • 7-Oxo-7H-furo[3,2-g][1]benzopyran-9-yl hexopyranoside
    • 7H-Furo(3,2-g)(1)benzopyran-7-one, 9-(beta-D-glucopyranosyloxy)-
    • Inchi: 1S/C17H16O9/c18-6-9-11(20)12(21)13(22)17(24-9)26-16-14-8(3-4-23-14)5-7-1-2-10(19)25-15(7)16/h1-5,9,11-13,17-18,20-22H,6H2/t9-,11-,12+,13-,17+/m1/s1
    • InChI Key: CXQMYXUCGMYFCD-QSDFBURQSA-N
    • SMILES: O([C@H]1[C@@H]([C@@H](O)[C@H](O)[C@@H](CO)O1)O)C1=C2OC=CC2=CC2C=CC(=O)OC1=2

Computed Properties

  • Exact Mass: 364.07943208g/mol
  • Monoisotopic Mass: 364.07943208g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 9
  • Heavy Atom Count: 26
  • Rotatable Bond Count: 3
  • Complexity: 566
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 5
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -0.2
  • Topological Polar Surface Area: 139?2
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