Analyte Name

7-Hydroxychlorpromazine-d6 O-beta-D-Glucuronide

Molecular Formula

C23 D6 H21 Cl N2 O7 S

Molecular Weight

517.025

Accurate Mass

516.16

SMILES

[2H]C([2H])([2H])N(CCCN1c2ccc(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)O)cc2Sc4ccc(Cl)cc14)C([2H])([2H])[2H]

InChI

InChI=1S/C23H27ClN2O7S/c1-25(2)8-3-9-26-14-6-5-13(11-17(14)34-16-7-4-12(24)10-15(16)26)32-23-20(29)18(27)19(28)21(33-23)22(30)31/h4-7,10-11,18-21,23,27-29H,3,8-9H2,1-2H3,(H,30,31)/t18-,19-,20+,21-,23+/m0/s1/i1D3,2D3

IUPAC

(2S,3S,4S,5R,6S)-6-[10-[3-[bis(trideuteriomethyl)amino]propyl]-8-chlorophenothiazin-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

Unlabelled CAS Number

15643-03-5

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat