Pregna-1,4-diene-3,20-dione, 2-bromo-9,11-epoxy-6-fluoro-16,17,21-trihydroxy-, (6β,9β,11β,16α)-
CAS Registry Number®
60864-70-2
No image available.
CAS Name
Pregna-1,4-diene-3,20-dione, 2-bromo-9,11-epoxy-6-fluoro-16,17,21-trihydroxy-, (6β,9β,11β,16α)-Molecular Formula
C21H24BrFO6Molecular Mass
471.31Cite this Page
Pregna-1,4-diene-3,20-dione, 2-bromo-9,11-epoxy-6-fluoro-16,17,21-trihydroxy-, (6β,9β,11β,16α)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=60864-70-2 (retrieved ) (CAS RN: 60864-70-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C21H24BrFO6/c1-18-7-17-21(29-17)10(9(18)5-15(26)20(18,28)16(27)8-24)3-13(23)11-4-14(25)12(22)6-19(11,21)2/h4,6,9-10,13,15,17,24,26,28H,3,5,7-8H2,1-2H3/t9-,10-,13+,15+,17-,18-,19-,20-,21+/m0/s1
InChIKey
InChIKey=FUBXEJMHWJJGLI-DOUMDCTRSA-N
SMILES
C[C@@]12[C@@]34[C@@](O3)(C[C@@]5(C)[C@]([C@@]4(C[C@@H](F)C1=CC(=O)C(Br)=C2)[H])(C[C@@H](O)[C@@]5(C(CO)=O)O)[H])[H]
Canonical SMILES
O=C1C=C2C(F)CC3C4CC(O)C(O)(C(=O)CO)C4(C)CC5OC53C2(C=C1Br)C
Other Names for this Substance
- Pregna-1,4-diene-3,20-dione, 2-bromo-9,11-epoxy-6-fluoro-16,17,21-trihydroxy-, (6β,9β,11β,16α)-
- 9,11-Epoxy-9H-cyclopenta[a]phenanthrene, pregna-1,4-diene-3,20-dione deriv.
