Cas no 17020-27-8 (9,19-Cyclolanostane-3,26-diol, 24-methylene-, (3b)-)

9,19-Cyclolanostane-3,26-diol, 24-methylene-, (3b)- structure
17020-27-8 structure
Product Name:9,19-Cyclolanostane-3,26-diol, 24-methylene-, (3b)-
CAS No:17020-27-8
MF:C31H52O2
MW:456.743390083313
CID:836955
PubChem ID:14314543
Update Time:2025-04-19

9,19-Cyclolanostane-3,26-diol, 24-methylene-, (3b)- Chemical and Physical Properties

Names and Identifiers

    • 9,19-Cyclolanostane-3,26-diol, 24-methylene-, (3b)-
    • 24-METHYLENECYCLOARTANE-3BETA,26-DIOL
    • 24-Methylenecycloartane-3β,26-diol
    • 4,4'-(2-Pyridinylmethylene)bis(2,6-dichlorophenol)
    • (3beta)-24-Methylene-9,19-cyclolanostane-3,26-diol
    • [ "" ]
    • 17020-27-8
    • (1S,3R,6S,8R,11S,12S,15R,16R)-15-[(2R)-7-hydroxy-6-methyl-5-methylideneheptan-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol
    • CHEMBL3892794
    • Inchi: 1S/C31H52O2/c1-20(22(3)18-32)8-9-21(2)23-12-14-29(7)25-11-10-24-27(4,5)26(33)13-15-30(24)19-31(25,30)17-16-28(23,29)6/h21-26,32-33H,1,8-19H2,2-7H3/t21-,22?,23-,24+,25+,26+,28-,29+,30-,31+/m1/s1
    • InChI Key: ONNNLYSDSXGHFE-FOFJNXILSA-N
    • SMILES: O[C@H]1CC[C@@]23[C@H](C1(C)C)CC[C@H]1[C@]4(C)CC[C@H]([C@H](C)CCC(=C)C(C)CO)[C@@]4(C)CC[C@@]21C3

Computed Properties

  • Exact Mass: 456.396730897g/mol
  • Monoisotopic Mass: 456.396730897g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 33
  • Rotatable Bond Count: 6
  • Complexity: 801
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 10
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 9.1
  • Topological Polar Surface Area: 40.5?2

Experimental Properties

  • Color/Form: Powder
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 476.8±40.0 °C at 760 mmHg
  • Flash Point: 242.2±27.3 °C
  • Vapor Pressure: 0.0±1.2 mmHg at 25°C

9,19-Cyclolanostane-3,26-diol, 24-methylene-, (3b)- Security Information

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