Cas no 20592-38-5 ((5alpha,17beta)-3-oxoandrostan-17-yl cyclohexanecarboxylate)

(5alpha,17beta)-3-oxoandrostan-17-yl cyclohexanecarboxylate structure
20592-38-5 structure
Product Name:(5alpha,17beta)-3-oxoandrostan-17-yl cyclohexanecarboxylate
CAS No:20592-38-5
MF:C26H40O3
MW:400.59400844574
CID:910079
PubChem ID:229456
Update Time:2025-04-19

(5alpha,17beta)-3-oxoandrostan-17-yl cyclohexanecarboxylate Chemical and Physical Properties

Names and Identifiers

    • (5alpha,17beta)-3-oxoandrostan-17-yl cyclohexanecarboxylate
    • 17.β.-hydroxyandrostan-3-one-17-hexahydrobenzoate
    • 17beta-Hydroxy-5alpha-androstan-3-one cyclohexanecarboxylate
    • 5.alpha.-Androstan-3-one, 17.beta.-hydroxy-, cyclohexanecarboxylate
    • DTXSID70942781
    • YOVFVQWNQMEMNF-LVYWIKMTSA-N
    • NSC23163
    • 17.beta.-hydroxyandrostan-3-one-17-hexahydrobenzoate
    • 17.beta.-Cyclohexylcarbonyloxy-5.alpha.-androstan-3-one
    • NSC-23163
    • Q27148919
    • 5.alpha.-Androstan-3-one, cyclohexanecarboxylate
    • 3-Oxoandrostan-17-yl cyclohexanecarboxylate
    • CHEBI:79785
    • [(5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl] cyclohexanecarboxylate
    • 20592-38-5
    • Inchi： 1S/C26H40O3/c1-25-14-12-19(27)16-18(25)8-9-20-21-10-11-23(26(21,2)15-13-22(20)25)29-24(28)17-6-4-3-5-7-17/h17-18,20-23H,3-16H2,1-2H3/t18-,20-,21-,22-,23-,25-,26-/m0/s1
    • InChI Key： YOVFVQWNQMEMNF-LVYWIKMTSA-N
    • SMILES： O(C(C1CCCCC1)=O)[C@H]1CC[C@@H]2[C@]1(C)CC[C@@H]1[C@@]3(C)CCC(C[C@@H]3CC[C@H]12)=O

Computed Properties

  • Exact Mass: 400.2979
  • Monoisotopic Mass: 400.29774513g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 29
  • Rotatable Bond Count: 3
  • Complexity: 665
  • 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: 6.3
  • Topological Polar Surface Area: 43.4?2

Experimental Properties

  • PSA: 43.37

(5alpha,17beta)-3-oxoandrostan-17-yl cyclohexanecarboxylate Related Literature

20592-38-5 ((5alpha,17beta)-3-oxoandrostan-17-yl cyclohexanecarboxylate) Related Products

Recommended suppliers
SunaTech Inc.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
SunaTech Inc.
PRIBOLAB PTE.LTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
PRIBOLAB PTE.LTD
Zhengzhou Baoyu Pharmaceutical Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Zhengzhou Baoyu Pharmaceutical Co., Ltd.
Hangzhou Cedareal Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Hangzhou Cedareal Technology Co., Ltd.
上海帛亦醫(yī)藥科技有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent