Analyte Name

Biallyloxy Enalaprilat Acyl Glucuronide

Molecular Formula

C30 H40 N2 O11

Molecular Weight

604.645

Accurate Mass

604.263

SMILES

C[C@H](N[C@H](CCc1ccccc1)C(=O)OCC=C)C(=O)N2CCC[C@@H]2C(=O)O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)OCC=C

InChI

InChI=1S/C30H40N2O11/c1-4-16-40-27(37)20(14-13-19-10-7-6-8-11-19)31-18(3)26(36)32-15-9-12-21(32)28(38)43-30-24(35)22(33)23(34)25(42-30)29(39)41-17-5-2/h4-8,10-11,18,20-25,30-31,33-35H,1-2,9,12-17H2,3H3/t18-,20+,21+,22-,23-,24+,25-,30-/m0/s1

IUPAC

[(2S,3R,4S,5S,6S)-3,4,5-trihydroxy-6-prop-2-enoxycarbonyloxan-2-yl] (2R)-1-[(2S)-2-[[(2R)-1-oxo-4-phenyl-1-prop-2-enoxybutan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat