Cas no 25122-47-8 (Pregna-1,4-diene-3,20-dione,21-chloro-9-fluoro-11-hydroxy-16-methyl-17-(1-oxobutoxy)-, (11b,16b)-)

Pregna-1,4-diene-3,20-dione,21-chloro-9-fluoro-11-hydroxy-16-methyl-17-(1-oxobutoxy)-, (11b,16b)- structure
25122-47-8 structure
Product Name:Pregna-1,4-diene-3,20-dione,21-chloro-9-fluoro-11-hydroxy-16-methyl-17-(1-oxobutoxy)-, (11b,16b)-
CAS No:25122-47-8
MF:C26H34ClFO5
MW:480.996571063995
CID:267207
PubChem ID:21116706
Update Time:2025-04-19

Pregna-1,4-diene-3,20-dione,21-chloro-9-fluoro-11-hydroxy-16-methyl-17-(1-oxobutoxy)-, (11b,16b)- Chemical and Physical Properties

Names and Identifiers

    • Pregna-1,4-diene-3,20-dione,21-chloro-9-fluoro-11-hydroxy-16-methyl-17-(1-oxobutoxy)-, (11b,16b)-
    • (9xi,11beta,16beta)-21-Chloro-9-fluoro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl butyrate
    • butanoic acid, (9xi,11beta,16beta)-21-chloro-9-fluoro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl ester
    • EUMOSONE
    • Q27284562
    • Pregna-1,4-diene-3,20-dione, 21-chloro-9-fluoro-11-hydroxy-16-methyl-17-(1-oxobutoxy)-, (11beta,16beta)-
    • UNII-N51W309113
    • (11.BETA.,16.BETA.)-21-CHLORO-9-FLUORO-11-HYDROXY-16-METHYL-17-(1-OXOBUTOXY)PREGNA-1,4-DIENE-3,20-DIONE
    • [(8S, 9R, 10S, 11S, 13S, 14S, 16S, 17R)-17-(2-chloroacetyl)-9-fluoro-11-hydroxy-10, 13, 16-trimethyl-3-oxo-6, 7, 8, 11, 12, 14, 15, 16-octahydrocyclopenta[a]phenanthren-17-yl] butanoate
    • 25122-47-8
    • PREGNA-1,4-DIENE-3,20-DIONE, 21-CHLORO-9-FLUORO-11-HYDROXY-16-METHYL-17-(1-OXOBUTOXY)-, (11.BETA.,16.BETA.)-
    • Clobetasol 17-butyrate
    • ClobetasolButyrate
    • N51W309113
    • SCHEMBL565893
    • Inchi： 1S/C26H34ClFO5/c1-5-6-22(32)33-26(21(31)14-27)15(2)11-19-18-8-7-16-12-17(29)9-10-23(16,3)25(18,28)20(30)13-24(19,26)4/h9-10,12,15,18-20,30H,5-8,11,13-14H2,1-4H3/t15-,18-,19-,20-,23-,24-,25-,26-/m0/s1
    • InChI Key： DERCOWNWEPPIHD-SOMXGXJRSA-N
    • SMILES： ClCC([C@]1([C@@H](C)C[C@H]2[C@@H]3CCC4=CC(C=C[C@]4(C)[C@]3([C@H](C[C@@]21C)O)F)=O)OC(CCC)=O)=O

Computed Properties

  • Exact Mass: 480.20802
  • Monoisotopic Mass: 480.2078800g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 33
  • Rotatable Bond Count: 6
  • Complexity: 945
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 8
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.6
  • Topological Polar Surface Area: 80.7?2

Experimental Properties

  • PSA: 80.67

Pregna-1,4-diene-3,20-dione,21-chloro-9-fluoro-11-hydroxy-16-methyl-17-(1-oxobutoxy)-, (11b,16b)- Related Literature

25122-47-8 (Pregna-1,4-diene-3,20-dione,21-chloro-9-fluoro-11-hydroxy-16-methyl-17-(1-oxobutoxy)-, (11b,16b)-) Related Products

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