Cas no 65066-26-4 ([(3s,3as,5as,5br,8s,10ar,10bs)-3-hydroxy-3a,5b-dimethyl-1,2,3,4,5,5a,6,7,8,9,10a,10b-dodecahydrocyclopenta[a]fluoren-8-yl] Acetate)

[(3s,3as,5as,5br,8s,10ar,10bs)-3-hydroxy-3a,5b-dimethyl-1,2,3,4,5,5a,6,7,8,9,10a,10b-dodecahydrocyclopenta[a]fluoren-8-yl] Acetate structure
65066-26-4 structure
Product Name:[(3s,3as,5as,5br,8s,10ar,10bs)-3-hydroxy-3a,5b-dimethyl-1,2,3,4,5,5a,6,7,8,9,10a,10b-dodecahydrocyclopenta[a]fluoren-8-yl] Acetate
CAS No:65066-26-4
MF:C20H30O3
MW:318.450406551361
CID:1684109
PubChem ID:255265
Update Time:2025-04-21

[(3s,3as,5as,5br,8s,10ar,10bs)-3-hydroxy-3a,5b-dimethyl-1,2,3,4,5,5a,6,7,8,9,10a,10b-dodecahydrocyclopenta[a]fluoren-8-yl] Acetate Chemical and Physical Properties

Names and Identifiers

    • [(3s,3as,5as,5br,8s,10ar,10bs)-3-hydroxy-3a,5b-dimethyl-1,2,3,4,5,5a,6,7,8,9,10a,10b-dodecahydrocyclopenta[a]fluoren-8-yl] Acetate
    • AC1L5S1H
    • AC1Q5X22
    • AG-K-14566
    • AR-1A4553
    • CTK5C2104
    • (3s,3as,5as,5br,8s,10ar,10bs)-3-hydroxy-3a,5b-dimethyl-1,2,3,3a,4,5,5a,5b,6,7,8,9,10a,10b-tetradecahydrocyclopenta[a]fluoren-8-yl acetate
    • NSC80624
    • KST-1A7164
    • AC1L5S1H; AC1Q5X22; AG-K-14566; AR-1A4553; CTK5C2104; (3s,3as,5as,5br,8s,10ar,10bs)-3-hydroxy-3a,5b-dimethyl-1,2,3,3a,4,5,5a,5b,6,7,8,9,10a,10b-tetradecahydrocyclopenta[a]fluoren-8-yl acetate; NSC80624; KST-1A7164;
    • NSC-80624
    • DTXSID50292170
    • 65066-26-4
    • Inchi： 1S/C20H30O3/c1-12(21)23-14-6-8-19(2)13(10-14)11-15-16-4-5-18(22)20(16,3)9-7-17(15)19/h11,14-18,22H,4-10H2,1-3H3/t14-,15-,16-,17-,18-,19-,20-/m0/s1
    • InChI Key： QOQGUAMQTHYADR-RBZZARIASA-N
    • SMILES： O[C@H]1CC[C@H]2[C@@H]3C=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@@]21C)OC(C)=O

Computed Properties

  • Exact Mass: 318.2196
  • Monoisotopic Mass: 318.21949481g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 2
  • Complexity: 553
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 7
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.5
  • Topological Polar Surface Area: 46.5?2

Experimental Properties

  • PSA: 46.53
  • LogP: 3.85170

[(3s,3as,5as,5br,8s,10ar,10bs)-3-hydroxy-3a,5b-dimethyl-1,2,3,4,5,5a,6,7,8,9,10a,10b-dodecahydrocyclopenta[a]fluoren-8-yl] Acetate Related Literature

65066-26-4 ([(3s,3as,5as,5br,8s,10ar,10bs)-3-hydroxy-3a,5b-dimethyl-1,2,3,4,5,5a,6,7,8,9,10a,10b-dodecahydrocyclopenta[a]fluoren-8-yl] Acetate) Related Products

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