Analyte Name

2-Hydroxy-5-methylphenyl beta-D-glucopyranosiduronic Acid

CAS Number

117591-51-2

Molecular Formula

C13 H16 O8

Molecular Weight

300.261

Accurate Mass

300.085

SMILES

Cc1ccc(O)c(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(=O)O)c1

InChI

InChI=1S/C13H16O8/c1-5-2-3-6(14)7(4-5)20-13-10(17)8(15)9(16)11(21-13)12(18)19/h2-4,8-11,13-17H,1H3,(H,18,19)/t8-,9-,10+,11-,13+/m0/s1

IUPAC

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(2-hydroxy-5-methylphenoxy)oxane-2-carboxylic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat