2-Acetamido-3-benzoyl-4,6-O-benzylidene-2-deoxy-D-galactopyranose

Analyte Name

2-Acetamido-3-benzoyl-4,6-O-benzylidene-2-deoxy-D-galactopyranose

Molecular Formula

C22 H23 N O7

Molecular Weight

413.421

Accurate Mass

413.147

SMILES

CC(=O)N[C@H]1C(O)O[C@@H]2COC(O[C@@H]2[C@@H]1OC(=O)c3ccccc3)c4ccccc4

InChI

InChI=1S/C22H23NO7/c1-13(24)23-17-19(29-20(25)14-8-4-2-5-9-14)18-16(28-21(17)26)12-27-22(30-18)15-10-6-3-7-11-15/h2-11,16-19,21-22,26H,12H2,1H3,(H,23,24)/t16-,17-,18+,19-,21?,22?/m1/s1

IUPAC

[(4aR,7R,8R,8aR)-7-acetamido-6-hydroxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl] benzoate

Alternate CAS Number

171973-76-5 - alpha isomer

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat