Pregna-1,4-diene-3,20-dione, 17-bromo-9,11-epoxy-6-fluoro-21-hydroxy-16-methyl-, (6β,9β,11β,16α)-

CAS Registry Number®

61339-44-4

CAS Name

Pregna-1,4-diene-3,20-dione, 17-bromo-9,11-epoxy-6-fluoro-21-hydroxy-16-methyl-, (6β,9β,11β,16α)-

Molecular Formula

C22H26BrFO4

Molecular Mass

453.34

Cite this Page

Pregna-1,4-diene-3,20-dione, 17-bromo-9,11-epoxy-6-fluoro-21-hydroxy-16-methyl-, (6β,9β,11β,16α)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=61339-44-4 (retrieved 2024-12-23) (CAS RN: 61339-44-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H26BrFO4/c1-11-6-13-14-8-16(24)15-7-12(26)4-5-19(15,2)22(14)18(28-22)9-20(13,3)21(11,23)17(27)10-25/h4-5,7,11,13-14,16,18,25H,6,8-10H2,1-3H3/t11-,13+,14+,16-,18+,19+,20+,21+,22-/m1/s1

InChIKey

InChIKey=AHRBEUCKLPVLDF-JPEOZNMXSA-N

SMILES

C[C@@]12[C@@]34[C@@](O3)(C[C@@]5(C)[C@]([C@@]4(C[C@@H](F)C1=CC(=O)C=C2)[H])(C[C@@H](C)[C@@]5(C(CO)=O)Br)[H])[H]

Canonical SMILES

O=C1C=CC2(C(=C1)C(F)CC3C4CC(C)C(Br)(C(=O)CO)C4(C)CC5OC532)C

Other Names for this Substance

  • Pregna-1,4-diene-3,20-dione, 17-bromo-9,11-epoxy-6-fluoro-21-hydroxy-16-methyl-, (6β,9β,11β,16α)-
  • 9,11-Epoxy-9H-cyclopenta[a]phenanthrene, pregna-1,4-diene-3,20-dione deriv.

CAS INSIGHTSTM
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