Pregna-1,4-diene-3,11,20-trione, 21-(fluoro-18F)-17-hydroxy-

CAS Registry Number®

110558-69-5

CAS Name

Pregna-1,4-diene-3,11,20-trione, 21-(fluoro-18F)-17-hydroxy-

Molecular Formula

C21H25FO4

Cite this Page

Pregna-1,4-diene-3,11,20-trione, 21-(fluoro-18F)-17-hydroxy-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=110558-69-5 (retrieved 2024-11-21) (CAS RN: 110558-69-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H25FO4/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-15,18,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1/i22-1

InChIKey

InChIKey=QQWLPAPHNPKYGT-JHZVGIEFSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@]([C@]4(C)C(CC3)=CC(=O)C=C4)(C(=O)C1)[H])[H])(CC[C@@]2(C(C[18F])=O)O)[H]

Canonical SMILES

O=C1C=CC2(C(=C1)CCC3C2C(=O)CC4(C)C3CCC4(O)C(=O)CF)C

Other Names for this Substance

  • Pregna-1,4-diene-3,11,20-trione, 21-(fluoro-18F)-17-hydroxy-
  • 21-[18F]Fluoroprednisone

CAS INSIGHTSTM
Targeted protein degrader structure, illustration