CHEBI:182423 - Hydroxyomeprazole-5-O-glucuronide

ChEBI IDCHEBI:182423
ChEBI NameHydroxyomeprazole-5-O-glucuronide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H27N3O10S
Net Charge0
Average Mass537.547
Monoisotopic Mass537.14172
SMILESCOc1ccc2nc(S(=O)Cc3ncc(COC4OC(C(=O)O)C(O)C(O)C4O)c(OC)c3C)nc2c1
InChIInChI=1S/C23H27N3O10S/c1-10-15(9-37(32)23-25-13-5-4-12(33-2)6-14(13)26-23)24-7-11(19(10)34-3)8-35-22-18(29)16(27)17(28)20(36-22)21(30)31/h4-7,16-18,20,22,27-29H,8-9H2,1-3H3,(H,25,26)(H,30,31)
InChIKeyKSOUCDYYCUDONG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Hydroxyomeprazole-5-O-glucuronide (CHEBI:182423) is a glucosiduronic acid (CHEBI:24302)
IUPAC Name 
3,4,5-trihydroxy-6-[[4-methoxy-6-[(6-methoxy-1H-benzimidazol-2-yl)sulinylmethyl]-5-methylpyridin-3-yl]methoxy]oxane-2-carboxylic acid