Analyte Name

Zaltoprofen-d7 beta-D-Glucuronide

Molecular Formula

C23 D7 H15 O9 S

Molecular Weight

481.524

Accurate Mass

481.142

SMILES

[2H]c1c([2H])c([2H])c2C(=O)Cc3cc(ccc3Sc2c1[2H])C(C(=O)O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(=O)O)C([2H])([2H])[2H]

InChI

InChI=1S/C23H22O9S/c1-10(22(30)32-23-19(27)17(25)18(26)20(31-23)21(28)29)11-6-7-15-12(8-11)9-14(24)13-4-2-3-5-16(13)33-15/h2-8,10,17-20,23,25-27H,9H2,1H3,(H,28,29)/t10?,17-,18-,19+,20-,23-/m0/s1/i1D3,2D,3D,4D,5D

IUPAC

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3,3,3-trideuterio-2-(7,8,9,10-tetradeuterio-6-oxo-5H-benzo[b][1]benzothiepin-3-yl)propanoyl]oxyoxane-2-carboxylic acid

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat