(6α)-21-(Acetyloxy)-6-fluoropregna-1,4,9(11),16-tetraene-3,20-dione

CAS Registry Number®

2476-74-6

CAS Name

(6α)-21-(Acetyloxy)-6-fluoropregna-1,4,9(11),16-tetraene-3,20-dione

Molecular Formula

C23H25FO4

Molecular Mass

384.44

Cite this Page

(6α)-21-(Acetyloxy)-6-fluoropregna-1,4,9(11),16-tetraene-3,20-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2476-74-6 (retrieved 2024-11-28) (CAS RN: 2476-74-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    188-190 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C23H25FO4/c1-13(25)28-12-21(27)18-5-4-16-15-11-20(24)19-10-14(26)6-8-23(19,3)17(15)7-9-22(16,18)2/h5-8,10,15-16,20H,4,9,11-12H2,1-3H3/t15-,16-,20-,22-,23+/m0/s1

InChIKey

InChIKey=UHEBHFQTEYMJQV-XDCJFQGASA-N

SMILES

C[C@@]12C=3[C@]([C@]4([C@](C)(CC3)C(C(COC(C)=O)=O)=CC4)[H])(C[C@H](F)C1=CC(=O)C=C2)[H]

Canonical SMILES

O=C1C=CC2(C(=C1)C(F)CC3C2=CCC4(C(=CCC34)C(=O)COC(=O)C)C)C

Other Names for this Substance

  • Pregna-1,4,9(11),16-tetraene-3,20-dione, 21-(acetyloxy)-6-fluoro-, (6α)-
  • Pregna-1,4,9(11),16-tetraene-3,20-dione, 6α-fluoro-21-hydroxy-, acetate
  • (6α)-21-(Acetyloxy)-6-fluoropregna-1,4,9(11),16-tetraene-3,20-dione

CAS INSIGHTSTM
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