2-Hydroxy Imipramine Beta-D-Glucuronide

Analyte Name

2-Hydroxy Imipramine beta-D-Glucuronide

CAS Number

54190-76-0

Molecular Formula

C25 H32 N2 O7

Molecular Weight

472.53

Accurate Mass

472.221

SMILES

CN(C)CCCN1c2ccccc2CCc3cc(OC4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(=O)O)ccc13

InChI

InChI=1S/C25H32N2O7/c1-26(2)12-5-13-27-18-7-4-3-6-15(18)8-9-16-14-17(10-11-19(16)27)33-25-22(30)20(28)21(29)23(34-25)24(31)32/h3-4,6-7,10-11,14,20-23,25,28-30H,5,8-9,12-13H2,1-2H3,(H,31,32)/t20-,21-,22+,23-,25?/m0/s1

IUPAC

(2S,3S,4S,5R)-6-[[11-[3-(dimethylamino)propyl]-5,6-dihydrobenzo[b][1]benzazepin-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

API Family

Imipramine