Analyte Name

1-((3R,5R)-6-Carboxy-3,5-dihydroxyhexyl)-2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrole 1-oxide

Molecular Formula

C33 H35 F N2 O6

Molecular Weight

574.639

Accurate Mass

574.247

SMILES

CC(C)C1=C(C(=O)Nc2ccccc2)C(=[C+](c3ccc(F)cc3)[N+]1([O-])CC[C@@H](O)C[C@@H](O)CC(=O)O)c4ccccc4

InChI

InChI=1S/C33H35FN2O6/c1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31,42)18-17-26(37)19-27(38)20-28(39)40/h3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40)/q+1/t26-,27-,36?/m1/s1

IUPAC

(3R,5R)-7-[2-(4-fluorophenyl)-1-oxido-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-ium-1-yl]-3,5-dihydroxyheptanoic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat