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CHEBI:749254 - esomeprazole sodium

Default Structure
ChEBI IDCHEBI:749254
ChEBI Nameesomeprazole sodium
Stars
Last Modified29 June 2026
SubmitterChEMBL
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/t24-;/m0./s1
InChIKeyRYXPMWYHEBGTRV-JIDHJSLPSA-N
Roles Classification
Application:
anti-ulcer drug  One of various classes of drugs with different action mechanisms used to treat or ameliorate peptic ulcer or irritation of the gastrointestinal tract.
ChEBI Ontology
Outgoing Relation(s)
esomeprazole sodium (CHEBI:749254) has role anti-ulcer drug (CHEBI:49201)
esomeprazole sodium (CHEBI:749254) is a benzimidazoles (CHEBI:22715)
esomeprazole sodium (CHEBI:749254) is a sulfoxide (CHEBI:22063)
Synonyms  Source
Esomeprazole (as sodium)ChEMBL
H199/18 SODIUMChEMBL
Citations