Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-21-(phosphonooxy)-, sodium salt (1:2), (11β)-

CAS Registry Number®

94088-00-3

CAS Name

Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-21-(phosphonooxy)-, sodium salt (1:2), (11β)-

Molecular Formula

C21H28FO8P.2Na

Cite this Page

Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-21-(phosphonooxy)-, sodium salt (1:2), (11β)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=94088-00-3 (retrieved 2024-12-23) (CAS RN: 94088-00-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H28FO8P.2Na/c1-18-7-5-13(23)9-12(18)3-4-15-14-6-8-20(26,17(25)11-30-31(27,28)29)19(14,2)10-16(24)21(15,18)22;;/h5,7,9,14-16,24,26H,3-4,6,8,10-11H2,1-2H3,(H2,27,28,29);;/t14-,15-,16-,18-,19-,20-,21-;;/m0../s1

InChIKey

InChIKey=TZGWKUILYNXKBG-VJVYSMTMSA-N

SMILES

F[C@@]12[C@]([C@]3([C@](C)(C[C@@H]1O)[C@](C(COP(=O)(O)O)=O)(O)CC3)[H])(CCC=4[C@]2(C)C=CC(=O)C4)[H].[Na]

Canonical SMILES

[Na].O=C1C=CC2(C(=C1)CCC3C4CCC(O)(C(=O)COP(=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-21-(phosphonooxy)-, sodium salt (1:2), (11β)-
  • Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-21-(phosphonooxy)-, disodium salt, (11β)-

CAS INSIGHTSTM
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