Analyte Name

4-Hydroxy Triazolam beta-D-Glucuronide

CAS Number

76960-93-5

Molecular Formula

C23 H20 Cl2 N4 O7

Molecular Weight

535.33

Accurate Mass

534.0709

SMILES

Cc1nnc2C(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)O)N=C(c4ccccc4Cl)c5cc(Cl)ccc5n12

InChI

InChI=1S/C23H20Cl2N4O7/c1-9-27-28-20-21(36-23-18(32)16(30)17(31)19(35-23)22(33)34)26-15(11-4-2-3-5-13(11)25)12-8-10(24)6-7-14(12)29(9)20/h2-8,16-19,21,23,30-32H,1H3,(H,33,34)/t16-,17-,18+,19-,21?,23-/m0/s1

IUPAC

(2S,3S,4S,5R,6S)-6-[[8-chloro-6-(2-chlorophenyl)-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-4-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat