Pregn-4-ene-3,20-dione, 17,21-epoxy-9-fluoro-11-hydroxy-, (11β)-

CAS Registry Number®

336-77-6

CAS Name

Pregn-4-ene-3,20-dione, 17,21-epoxy-9-fluoro-11-hydroxy-, (11β)-

Molecular Formula

C21H27FO4

Molecular Mass

362.44

Cite this Page

Pregn-4-ene-3,20-dione, 17,21-epoxy-9-fluoro-11-hydroxy-, (11β)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=336-77-6 (retrieved 2024-11-23) (CAS RN: 336-77-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    236 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H27FO4/c1-18-7-5-13(23)9-12(18)3-4-15-14-6-8-20(17(25)11-26-20)19(14,2)10-16(24)21(15,18)22/h9,14-16,24H,3-8,10-11H2,1-2H3/t14-,15-,16-,18-,19-,20-,21-/m0/s1

InChIKey

InChIKey=NVDNCLODVOXYKU-BULBTXNYSA-N

SMILES

C[C@@]12[C@]3(CC[C@]1([C@]4([C@](F)([C@@H](O)C2)[C@]5(C)C(CC4)=CC(=O)CC5)[H])[H])C(=O)CO3

Canonical SMILES

O=C1C=C2CCC3C4CCC5(OCC5=O)C4(C)CC(O)C3(F)C2(C)CC1

Other Names for this Substance

  • Pregn-4-ene-3,20-dione, 17,21-epoxy-9-fluoro-11-hydroxy-, (11β)-
  • Pregn-4-ene-3,20-dione, 17,21-epoxy-9-fluoro-11β-hydroxy-
  • Progesterone, 17,21-epoxy-9-fluoro-11β-hydroxy-
  • Spiro[17H-cyclopenta[a]phenanthrene-17,2′-oxetane], pregn-4-ene-3,20-dione deriv.
  • NSC 47440

CAS INSIGHTSTM
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