Cas no 34635-41-1 ((3S,10R,13S)-3-Hydroxy-10,13-dimethyl-3,4,7,8,9,10,11,12,13,16-decahydro-1H-cyclopenta[a]phenanthren-17(2H)-one)

(3S,10R,13S)-3-Hydroxy-10,13-dimethyl-3,4,7,8,9,10,11,12,13,16-decahydro-1H-cyclopenta[a]phenanthren-17(2H)-one structure
34635-41-1 structure
Product Name:(3S,10R,13S)-3-Hydroxy-10,13-dimethyl-3,4,7,8,9,10,11,12,13,16-decahydro-1H-cyclopenta[a]phenanthren-17(2H)-one
CAS No:34635-41-1
MF:C19H26O2
MW:286.408545970917
CID:295010
PubChem ID:57349103
Update Time:2025-04-19

(3S,10R,13S)-3-Hydroxy-10,13-dimethyl-3,4,7,8,9,10,11,12,13,16-decahydro-1H-cyclopenta[a]phenanthren-17(2H)-one Chemical and Physical Properties

Names and Identifiers

    • (3S,10R,13S)-3-Hydroxy-10,13-dimethyl-3,4,7,8,9,10,11,12,13,16-decahydro-1H-cyclopenta[a]phenanthren-17(2H)-one
    • (3S,10R,13S)-3-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,16-decahydrocyclopenta[a]phenanthren-17-one
    • Androsta-5,14-dien-17-one,3-hydroxy-, (3b)-(9CI)
    • 3b-Hydroxyandrosta-5,14-dien-17-one
    • Androst-5,14-dien-17-one, 3b-hydroxy-
    • AKOS022178655
    • 34635-41-1
    • (7S,9aR,11aS)-7-hydroxy-9a,11a-dimethyl-1H,2H,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-one
    • Inchi: 1S/C19H26O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,5,13-14,16,20H,4,6-11H2,1-2H3/t13-,14?,16?,18-,19-/m0/s1
    • InChI Key: JAESBNKKCUYQHC-XLLZLZEESA-N
    • SMILES: O[C@H]1CC[C@@]2(C)C(C1)=CCC1C3=CCC([C@@]3(C)CCC21)=O

Computed Properties

  • Exact Mass: 286.193280068g/mol
  • Monoisotopic Mass: 286.193280068g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 0
  • Complexity: 558
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 3
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.6
  • Topological Polar Surface Area: 37.3?2
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