5-Bromo-4-chloro-3-indolyl 2-Acetamido-2-deoxy-3,​4,​6-​triacetate-alpha-D-galactopyranoside

Analyte Name

5-Bromo-4-chloro-3-indolyl 2-Acetamido-2-deoxy-3,4,6-triacetate-alpha-D-galactopyranoside

Molecular Formula

C22 H24 Br Cl N2 O9

Molecular Weight

575.791

Accurate Mass

574.035

SMILES

CC(=O)N[C@H]1C(Oc2c[nH]c3ccc(Br)c(Cl)c23)O[C@H](COC(=O)C)[C@H](OC(=O)C)[C@@H]1OC(=O)C

InChI

InChI=1S/C22H24BrClN2O9/c1-9(27)26-19-21(33-12(4)30)20(32-11(3)29)16(8-31-10(2)28)35-22(19)34-15-7-25-14-6-5-13(23)18(24)17(14)15/h5-7,16,19-22,25H,8H2,1-4H3,(H,26,27)/t16-,19-,20+,21-,22?/m1/s1

IUPAC

[(2R,3R,4R,5R)-5-acetamido-3,4-diacetyloxy-6-[(5-bromo-4-chloro-1H-indol-3-yl)oxy]oxan-2-yl]methyl acetate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat