Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-16-methyl-21-(sulfooxy)-, sodium salt (1:1), (11β,16α)-

CAS Registry Number®

466-11-5

CAS Name

Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-16-methyl-21-(sulfooxy)-, sodium salt (1:1), (11β,16α)-

Molecular Formula

C22H29FO8S.Na

Cite this Page

Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-16-methyl-21-(sulfooxy)-, sodium salt (1:1), (11β,16α)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=466-11-5 (retrieved 2024-11-08) (CAS RN: 466-11-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    182 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C22H29FO8S.Na/c1-12-8-16-15-5-4-13-9-14(24)6-7-19(13,2)21(15,23)17(25)10-20(16,3)22(12,27)18(26)11-31-32(28,29)30;/h6-7,9,12,15-17,25,27H,4-5,8,10-11H2,1-3H3,(H,28,29,30);/t12-,15+,16+,17+,19+,20+,21+,22+;/m1./s1

InChIKey

InChIKey=XEOLZDWFEADLIM-WKSAPEMMSA-N

SMILES

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

Canonical SMILES

[Na].O=C1C=CC2(C(=C1)CCC3C4CC(C)C(O)(C(=O)COS(=O)(=O)O)C4(C)CC(O)C32F)C

Other Names for this Substance

  • Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-16-methyl-21-(sulfooxy)-, sodium salt (1:1), (11β,16α)-
  • Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-16-methyl-21-(sulfooxy)-, monosodium salt, (11β,16α)-
  • Pregna-1,4-diene-3,20-dione, 9-fluoro-11β,17,21-trihydroxy-16α-methyl-, 21-(hydrogen sulfate), monosodium salt
  • Dexamethasone sodium hemisulfate
  • Dexamethasone 21-hemisulfate sodium salt

View All

Deleted or Replaced CAS Registry Numbers

4008-19-9

CAS INSIGHTSTM
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