(6α,11β)-21-(Acetyloxy)-6,9-difluoro-11-hydroxypregna-1,4,16-triene-3,20-dione

CAS Registry Number®

2326-26-3

CAS Name

(6α,11β)-21-(Acetyloxy)-6,9-difluoro-11-hydroxypregna-1,4,16-triene-3,20-dione

Molecular Formula

C23H26F2O5

Molecular Mass

420.45

Cite this Page

(6α,11β)-21-(Acetyloxy)-6,9-difluoro-11-hydroxypregna-1,4,16-triene-3,20-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2326-26-3 (retrieved 2024-11-22) (CAS RN: 2326-26-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    209-210 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C23H26F2O5/c1-12(26)30-11-19(28)15-5-4-14-16-9-18(24)17-8-13(27)6-7-22(17,3)23(16,25)20(29)10-21(14,15)2/h5-8,14,16,18,20,29H,4,9-11H2,1-3H3/t14-,16-,18-,20-,21-,22-,23-/m0/s1

InChIKey

InChIKey=YXASFOVLXBFEEU-LKVAYOKUSA-N

SMILES

F[C@@]12[C@]([C@]3([C@](C)(C[C@@H]1O)C(C(COC(C)=O)=O)=CC3)[H])(C[C@H](F)C=4[C@]2(C)C=CC(=O)C4)[H]

Canonical SMILES

O=C1C=CC2(C(=C1)C(F)CC3C4CC=C(C(=O)COC(=O)C)C4(C)CC(O)C32F)C

Other Names for this Substance

  • Pregna-1,4,16-triene-3,20-dione, 21-(acetyloxy)-6,9-difluoro-11-hydroxy-, (6α,11β)-
  • Pregna-1,4,16-triene-3,20-dione, 6α,9-difluoro-11β,21-dihydroxy-, 21-acetate
  • (6α,11β)-21-(Acetyloxy)-6,9-difluoro-11-hydroxypregna-1,4,16-triene-3,20-dione

CAS INSIGHTSTM
Targeted protein degrader structure, illustration