Analyte Name

2-Hydroxy-4-(methyl-d3)phenyl beta-D-glucopyranosiduronic Acid

Molecular Formula

C13 D3 H13 O8

Molecular Weight

303.28

Accurate Mass

303.103

SMILES

[2H]C([2H])([2H])c1ccc(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(=O)O)c(O)c1

InChI

InChI=1S/C13H16O8/c1-5-2-3-7(6(14)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/i1D3

IUPAC

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-hydroxy-4-(trideuteriomethyl)phenoxy]oxane-2-carboxylic acid

Unlabelled CAS Number

81742-15-6

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat