Cas no 55306-15-5 (Bryacarpen-2)

Bryacarpen-2 structure
Bryacarpen-2 structure
Product Name:Bryacarpen-2
CAS No:55306-15-5
MF:C18H16O6
MW:328.316045761108
CID:1995678
PubChem ID:44257501
Update Time:2025-04-21

Bryacarpen-2 Chemical and Physical Properties

Names and Identifiers

    • Bryacarpen-2
    • Bryacarpene 2
    • bryacarpene-2
    • 3,8,9-Trimethoxy-6H-benzofuro[3,2-c][1]benzopyran-10-ol
    • 10-Hydroxy-3,8,9-trimethoxypterocarpene
    • XB161665
    • 55306-15-5
    • LMPK12070154
    • 3,8,9-trimethoxy-6H-(1)benzofuro(3,2-c)chromen-10-ol
    • 3,8,9-trimethoxy-6H-[1]benzofuro[3,2-c]chromen-10-ol
    • DB-293976
    • Inchi: 1S/C18H16O6/c1-20-9-4-5-10-13(6-9)23-8-12-11-7-14(21-2)18(22-3)15(19)17(11)24-16(10)12/h4-7,19H,8H2,1-3H3
    • InChI Key: WAKKZAYCWOUZJK-UHFFFAOYSA-N
    • SMILES: O1C2C(=C(C(=CC=2C2COC3C=C(C=CC=3C1=2)OC)OC)OC)O

Computed Properties

  • Exact Mass: 328.09468823g/mol
  • Monoisotopic Mass: 328.09468823g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 3
  • Complexity: 445
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.1
  • Topological Polar Surface Area: 70.3?2
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