(11β,14β,16β,17α)-9-Fluoro-11,21-dihydroxy-16-methyl-3,20-dioxo(4,6,21,21-²H₄)pregna-1,4-dien-17-yl propionate

More details:

• Systematic name

  [(8S,9R,10S,11S,13S,14R,16S,17S)-4,6-dideuterio-17-(2,2-dideuterio-2-hydroxy-acetyl)-9-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate

• SMILES

  [2H]C([2H])(O)C(=O)[C@]1(OC(=O)CC)[C@@H](C)C[C@@H]2[C@@H]3CC([2H])C4=C([2H])C(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C

• Std. InChi

  InChI=1S/C25H33FO6/c1-5-21(31)32-25(20(30)13-27)14(2)10-18-17-7-6-15-11-16(28)8-9-22(15,3)24(17,26)19(29)12-23(18,25)4/h8-9,11,14,17-19,27,29H,5-7,10,12-13H2,1-4H3/t14-,17-,18+,19-,22-,23-,24-,25+/m0/s1/i6D,11D,13D2/t6?,14-,17-,18+,19-,22-,23-,24-,25+

• Std. InChIKey

  ITYMTTQVNYAJAA-TXYHVIOZSA-N

• Cite this record

  CSID:107446411, http://www.chemspider.com/Chemical-Structure.107446411.html (accessed 15:53, Apr 30, 2024)