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CHEBI:31934 - Omeprazole sodium

ChEBI IDCHEBI:31934
ChEBI NameOmeprazole sodium
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC17H18N3O3S.Na
Net Charge0
Average Mass367.406
Monoisotopic Mass367.09666
SMILESCOc1ccc2[n-]c(S(=O)Cc3ncc(C)c(OC)c3C)nc2c1.[Na+]
InChIInChI=1S/C17H18N3O3S.Na/c1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17;/h5-8H,9H2,1-4H3;/q-1;+1
InChIKeyRYXPMWYHEBGTRV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Omeprazole sodium (CHEBI:31934) is a benzimidazoles (CHEBI:22715)
Omeprazole sodium (CHEBI:31934) is a sulfoxide (CHEBI:22063)
Synonym  Source
Omeprazole sodiumKEGG COMPOUND
Manual XrefsDatabases
D01207KEGG DRUG
Registry NumbersSources
CAS:95510-70-6KEGG COMPOUND
CAS:142706-19-2KEGG COMPOUND