Cas no 20805-90-7 (Gona-4,9,11-trien-3-one,17a-allyl-13-ethyl-17-hydroxy- (8CI))

Gona-4,9,11-trien-3-one,17a-allyl-13-ethyl-17-hydroxy- (8CI) structure
20805-90-7 structure
Product Name:Gona-4,9,11-trien-3-one,17a-allyl-13-ethyl-17-hydroxy- (8CI)
CAS No:20805-90-7
MF:C22H28O2
MW:324.456526756287
CID:289613
PubChem ID:273186
Update Time:2025-04-19

Gona-4,9,11-trien-3-one,17a-allyl-13-ethyl-17-hydroxy- (8CI) Chemical and Physical Properties

Names and Identifiers

    • Gona-4,9,11-trien-3-one,17a-allyl-13-ethyl-17-hydroxy- (8CI)
    • 13-ethyl-17-hydroxy-17-prop-2-enyl-1,2,6,7,8,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
    • 13-ethyl-17-hydroxy-17-(prop-2-en-1-yl)-1,2,6,7,8,13,14,15,16,17-decahydro-3h-cyclopenta[a]phenanthren-3-one(non-preferred name)
    • AC1L6ST4
    • AC1Q6OFQ
    • AR-1C0742
    • NSC118187
    • NSC-118187
    • 20805-90-7
    • DTXSID90297801
    • Inchi： 1S/C22H28O2/c1-3-11-22(24)13-10-20-19-7-5-15-14-16(23)6-8-17(15)18(19)9-12-21(20,22)4-2/h3,9,12,14,19-20,24H,1,4-8,10-11,13H2,2H3
    • InChI Key： FONGKBHEMRCMIW-UHFFFAOYSA-N
    • SMILES： OC1(CC=C)CCC2C3CCC4=CC(CCC4=C3C=CC21CC)=O

Computed Properties

  • Exact Mass: 324.20904
  • Monoisotopic Mass: 324.208930132g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 3
  • Complexity: 680
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 4
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.2
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • PSA: 37.3
  • LogP: 4.66570

Gona-4,9,11-trien-3-one,17a-allyl-13-ethyl-17-hydroxy- (8CI) Related Literature

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