Pregna-1,4-diene-3,20-dione, 9-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]-21-[(1-oxopentyl)oxy]-, (11β,16α)-

CAS Registry Number®

51112-52-8

CAS Name

Pregna-1,4-diene-3,20-dione, 9-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]-21-[(1-oxopentyl)oxy]-, (11β,16α)-

Molecular Formula

C29H39FO7

Molecular Mass

518.61

Cite this Page

Pregna-1,4-diene-3,20-dione, 9-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]-21-[(1-oxopentyl)oxy]-, (11β,16α)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=51112-52-8 (retrieved 2024-09-28) (CAS RN: 51112-52-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C29H39FO7/c1-6-7-8-24(34)35-16-22(33)29-23(36-25(2,3)37-29)14-20-19-10-9-17-13-18(31)11-12-26(17,4)28(19,30)21(32)15-27(20,29)5/h11-13,19-21,23,32H,6-10,14-16H2,1-5H3/t19-,20-,21-,23+,26-,27-,28-,29+/m0/s1

InChIKey

InChIKey=JFOVIARCZOJXST-GIHRJZAFSA-N

SMILES

C(COC(CCCC)=O)(=O)[C@]12[C@]3(C)[C@@](C[C@]1(OC(C)(C)O2)[H])([C@]4([C@](F)([C@@H](O)C3)[C@]5(C)C(CC4)=CC(=O)C=C5)[H])[H]

Canonical SMILES

O=C1C=CC2(C(=C1)CCC3C4CC5OC(OC5(C(=O)COC(=O)CCCC)C4(C)CC(O)C32F)(C)C)C

Other Names for this Substance

  • Pregna-1,4-diene-3,20-dione, 9-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]-21-[(1-oxopentyl)oxy]-, (11β,16α)-
  • 2H-Naphth[2′,1′:4,5]indeno[1,2-d][1,3]dioxole, pregna-1,4-diene-3,20-dione deriv.
  • Triamcinolone acetonide 21-valerate

CAS INSIGHTSTM
© Nobel Prize Outreach. Photo: Hugh Fox