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Substance Name: Disodium isoflupredone 21-phosphate
RN: 94088-00-3
UNII: 4FAV8MZ1BT
InChIKey: RJCHGSGXNBHMRH-VJVYSMTMSA-L

Molecular Formula

  • C21-H28-F-O8-P.2Na

Molecular Weight

  • 502.3804
 
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Names and Synonyms

Name of Substance

  • Disodium isoflupredone 21-phosphate

Synonyms

  • EINECS 301-996-2
  • UNII-4FAV8MZ1BT

Systematic Name

  • Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-21-(phosphonooxy)-, disodium salt, (11beta)-

Registry Numbers

CAS Registry Number

  • 94088-00-3

FDA UNII

  • 4FAV8MZ1BT

System Generated Number

  • 0094088003

Molecular Formulas

Molecular Formula

  • C21-H28-F-O8-P.2Na

Molecular Formula Fragments

  • C21-H28-F-O8-P
  • COMPONENT
  • Na

Structure Descriptors

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);;/q;2*+1/p-2/t14-,15-,16-,18-,19-,20-,21-;;/m0../s1

InChIKey

RJCHGSGXNBHMRH-VJVYSMTMSA-L

Smiles

[Na+].[Na+].C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CC[C@]2(O)C(=O)COP(=O)([O-])[O-]