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CHEBI:149522 - candesartan O-β-D-glucuronoside(2−)

ChEBI IDCHEBI:149522
ChEBI Namecandesartan O-β-D-glucuronoside(2−)
Stars
ASCII Namecandesartan O-beta-D-glucuronoside(2-)
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC30H26N6O9
Net Charge-2
Average Mass614.571
Monoisotopic Mass614.17722
SMILESCCOc1nc2cccc(C(=O)O[C@@H]3O[C@H](C(=O)[O-])[C@@H](O)[C@H](O)[C@H]3O)c2n1Cc1ccc(-c2ccccc2-c2nnn[n-]2)cc1
InChIInChI=1S/C30H28N6O9/c1-2-43-30-31-20-9-5-8-19(28(42)45-29-24(39)22(37)23(38)25(44-29)27(40)41)21(20)36(30)14-15-10-12-16(13-11-15)17-6-3-4-7-18(17)26-32-34-35-33-26/h3-13,22-25,29,37-39H,2,14H2,1H3,(H2,32,33,34,35,40,41)/p-2/t22-,23-,24+,25-,29-/m0/s1
InChIKeyQUWFWLVOMRZLER-GMQKQUAPSA-L
ChEBI Ontology
Outgoing Relation(s)
candesartan O-β-D-glucuronoside(2−) (CHEBI:149522) is a β-D-glucosiduronate (CHEBI:83411)
UniProt Name  Source
candesartan O-β-D-glucuronosideUniProt
Citations