3-HYDROXY DESLORATADINE BETA-D-GLUCURONIDE

CAS No.
774538-89-5
CCD No.
CCD00897091
Formula
C25 H27 Cl N2 O7
MolWeight
502.948

Basic Information

Product Name: 3-HYDROXY DESLORATADINE BETA-D-GLUCURONIDE
CAS: 774538-89-5
English Synonyms: 3-HYDROXY DESLORATADINE B-D-GLUCURONIDE ; 3-HYDROXY DESLORATADINE GLUCURONIDE ; M13 METABOLITE ; 8-CHLORO-6,11-DIHYDRO-11-(4-PIPERIDINYLIDENE)-5H-BENZO[5,6]CYCLOHEPTA[1,2-B]PYRIDIN-3-YL BETA-D-GLUCOPYRANOSIDURONIC ACID ; 3-HYDROXY DESLORATADINE BETA-D-GLUCURONIDE
MDL Number.: MFCD09952219
H bond acceptor: 9
H bond donor: 5
Smile: c1cc2c(cc1Cl)CCc3cc(cnc3C2=C4CCNCC4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O
InChi: 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-,25+/m0/s1
InChiKey: InChIKey=XLMRWMPRWQUMIJ-LYVDORBWSA-N

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