For research use only. Not for therapeutic Use.
Catalog Number | R013329 |
CAS Number | 1316291-19-6 |
Synonyms | 7-(4-Fluorophenyl)hexahydro-β,7-dihydroxy-1b-(1-methylethyl)-7a-phenyl-1a-[(phenylamino)carbonyl]-3H-oxireno[3,4]pyrrolo[2,1-b][1,3]oxazine-3-butanoic Acid Sodium Salt; ATV-cycloIP Sodium Salt; ATV-FXA sodium salt? |
Molecular Formula | C33H35FN2NaO7 |
Purity | ≥95% |
Storage | Store at RT |
IUPAC Name | 4-[7-(4-fluorophenyl)-7-hydroxy-7a-phenyl-1a-(phenylcarbamoyl)-1b-propan-2-yl-4,5-dihydro-3H-oxireno[1,2]pyrrolo[4,5-b][1,3]oxazin-3-yl]-3-hydroxybutanoic acid;sodium |
InChI | InChI=1S/C33H35FN2O7.Na/c1-21(2)33-31(29(40)35-25-11-7-4-8-12-25)30(43-31,22-9-5-3-6-10-22)32(41,23-13-15-24(34)16-14-23)36(33)18-17-27(42-33)19-26(37)20-28(38)39;/h3-16,21,26-27,37,41H,17-20H2,1-2H3,(H,35,40)(H,38,39); |
InChIKey | XSBRPKONJANHID-UHFFFAOYSA-N |
SMILES | CC(C)C12C3(C(O3)(C(N1CCC(O2)CC(CC(=O)O)O)(C4=CC=C(C=C4)F)O)C5=CC=CC=C5)C(=O)NC6=CC=CC=C6.[Na] |