3-Hydroxy Desloratadine beta-D-Glucuronide
[CAS# 774538-89-5]

Identification

• Name: 3-Hydroxy Desloratadine beta-D-Glucuronide
• Synonyms: 8-Chloro-6,11-Dihydro-11-(4-Piperidinylidene)-5H-Benzo[5,6]Cyclohepta[1,2-B]Pyridin-3-Yl B-D-Glucopyranosiduronic Acid; 8-Chloro-6,11-Dihydro-11-(4-Piperidinylidene)-5H-Benzo[5,6]Cyclohepta[1,2-B]Pyridin-3-Yl -D-Glucopyranosiduronic Acid; 3-Hydroxy Desloratadine B-D-Glucuronide
• Molecular Formula: C₂₅H₂₇ClN₂O₇
• Molecular Weight: 502.94
• CAS Registry Number: 774538-89-5
• SMILES: OC(=O)[C@H]1O[C@@H](Oc2cnc3c(c2)CCc2c(C3=C3CCNCC3)ccc(c2)Cl)[C@@H]([C@H]([C@@H]1O)O)O
• InChI: 1S/C25H27ClN2O7/c26-15-3-4-17-13(9-15)1-2-14-10-16(11-28-19(14)18(17)12-5-7-27-8-6-12)34-25-22(31)20(29)21(30)23(35-25)24(32)33/h3-4,9-11,20-23,25,27,29-31H,1-2,5-8H2,(H,32,33)/t20-,21-,22+,23-,