Cas no 20086-07-1 (Diosbulbin C)

Diosbulbin C structure
Diosbulbin C structure
Product Name:Diosbulbin C
CAS No:20086-07-1
MF:C19H22O7
MW:362.373786449432
CID:259866
PubChem ID:15559045
Update Time:2025-04-19

Diosbulbin C Chemical and Physical Properties

Names and Identifiers

    • Diosbulbin C
    • [ "" ]
    • AKOS040761631
    • 3-(furan-3-yl)-8-hydroxy-5-methyl-14-oxo-2,13-dioxatetracyclo[10.2.1.01,5.06,11]pentadecane-10-carboxylic acid
    • 3-(furan-3-yl)-8-hydroxy-5-methyl-14-oxo-2,13-dioxatetracyclo[10.2.1.0^{1,5}.0^{6,11}]pentadecane-10-carboxylic acid
    • 20086-07-1
    • 3-(uran-3-yl)-8-hydroxy-5-methyl-14-oxo-2,13-dioxatetracyclo[10.2.1.01,5.06,11]pentadecane-10-carboxylic acid
    • (3R,5S,6R,8R,10R,11S,12S)-3-(Furan-3-yl)-8-hydroxy-5-methyl-14-oxo-2,13-dioxatetracyclo[10.2.1.01,5.06,11]pentadecane-10-carboxylic acid
    • 3-(furan-3-yl)-8-hydroxy-5-methyl-14-oxo-2, 13-dioxatetracyclo[10.2.1.01, 5.06, 11]pentadecane-10-carboxylic acid
    • CHEBI:175644
    • Inchi: 1S/C19H22O7/c1-18-6-13(9-2-3-24-8-9)26-19(18)7-14(25-17(19)23)15-11(16(21)22)4-10(20)5-12(15)18/h2-3,8,10-15,20H,4-7H2,1H3,(H,21,22)
    • InChI Key: UYALWPKCIMKALF-UHFFFAOYSA-N
    • SMILES: O1C(C2=COC=C2)CC2(C)C31C(=O)OC(C3)C1C(C(=O)O)CC(CC21)O

Computed Properties

  • Exact Mass: 362.13656
  • Monoisotopic Mass: 362.136553
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 26
  • Rotatable Bond Count: 2
  • Complexity: 650
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 7
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 106
  • XLogP3: 1.1

Experimental Properties

  • Color/Form: Powder
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 606.0±55.0 °C at 760 mmHg
  • Flash Point: 320.3±31.5 °C
  • Refractive Index: 1.62
  • PSA: 106.2
  • LogP: 1.90310
  • Vapor Pressure: 0.0±1.8 mmHg at 25°C

Diosbulbin C Security Information

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