Analyte Name

Sulfameter N1-Glucuronide-d4

Molecular Formula

C17 D4 H16 N4 O9 S

Molecular Weight

460.452

Accurate Mass

460.12

SMILES

[2H]c1c([2H])c(c([2H])c([2H])c1N)S(=O)(=O)N([C@@H]2O[C@@H]([C@@H](O)C(O)[C@H]2O)C(=O)O)c3ncc(OC)cn3

InChI

InChI=1S/C17H20N4O9S/c1-29-9-6-19-17(20-7-9)21(31(27,28)10-4-2-8(18)3-5-10)15-13(24)11(22)12(23)14(30-15)16(25)26/h2-7,11-15,22-24H,18H2,1H3,(H,25,26)/t11?,12-,13+,14-,15+/m0/s1/i2D,3D,4D,5D

IUPAC

(2S,3S,5R,6R)-6-[(4-amino-2,3,5,6-tetradeuteriophenyl)sulfonyl-(5-methoxypyrimidin-2-yl)amino]-3,4,5-trihydroxyoxane-2-carboxylic acid

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat