(11β,16β)-17,21-[(1-Ethoxypropylidene)bis(oxy)]-9-fluoro-11-hydroxy-16-methylpregna-1,4-diene-3,20-dione

CAS Registry Number®

1062-09-5

CAS Name

(11β,16β)-17,21-[(1-Ethoxypropylidene)bis(oxy)]-9-fluoro-11-hydroxy-16-methylpregna-1,4-diene-3,20-dione

Molecular Formula

C27H37FO6

Molecular Mass

476.58

Cite this Page

(11β,16β)-17,21-[(1-Ethoxypropylidene)bis(oxy)]-9-fluoro-11-hydroxy-16-methylpregna-1,4-diene-3,20-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1062-09-5 (retrieved 2024-11-22) (CAS RN: 1062-09-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    205-212 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C27H37FO6/c1-6-25(32-7-2)33-15-22(31)27(34-25)16(3)12-20-19-9-8-17-13-18(29)10-11-23(17,4)26(19,28)21(30)14-24(20,27)5/h10-11,13,16,19-21,30H,6-9,12,14-15H2,1-5H3/t16-,19-,20-,21-,23-,24-,25?,26-,27-/m0/s1

InChIKey

InChIKey=INPXAEPGZXIOQQ-DOKRWBFCSA-N

SMILES

C[C@@]12[C@]3(OC(OCC)(CC)OCC3=O)[C@@H](C)C[C@]1([C@]4([C@](F)([C@@H](O)C2)[C@]5(C)C(CC4)=CC(=O)C=C5)[H])[H]

Canonical SMILES

O=C1C=CC2(C(=C1)CCC3C4CC(C)C5(OC(OCC5=O)(OCC)CC)C4(C)CC(O)C32F)C

Other Names for this Substance

  • Pregna-1,4-diene-3,20-dione, 17,21-[(1-ethoxypropylidene)bis(oxy)]-9-fluoro-11-hydroxy-16-methyl-, (11β,16β)-
  • Pregna-1,4-diene-3,20-dione, 9-fluoro-11β,17,21-trihydroxy-16β-methyl-, cyclic 17,21-(ethyl orthopropionate)
  • (11β,16β)-17,21-[(1-Ethoxypropylidene)bis(oxy)]-9-fluoro-11-hydroxy-16-methylpregna-1,4-diene-3,20-dione