N-Methyl Dexmedetomidine-O-glucuronide

Analyte Name

N-Methyl Dexmedetomidine-O-glucuronide

Molecular Formula

C20 H26 N2 O7

Molecular Weight

406.43

Accurate Mass

406.174

SMILES

C[C@H](c1cn(C)cn1)c2cccc(COC3OC(C(O)C(O)C3O)C(=O)O)c2C

InChI

InChI=1S/C20H26N2O7/c1-10-12(5-4-6-13(10)11(2)14-7-22(3)9-21-14)8-28-20-17(25)15(23)16(24)18(29-20)19(26)27/h4-7,9,11,15-18,20,23-25H,8H2,1-3H3,(H,26,27)/t11-,15?,16?,17?,18?,20?/m0/s1

IUPAC

3,4,5-trihydroxy-6-[[2-methyl-3-[(1S)-1-(1-methylimidazol-4-yl)ethyl]phenyl]methoxy]oxane-2-carboxylic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat