CHEBI:77264 - esomeprazole(1−)

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ChEBI Name esomeprazole(1−)
ChEBI ID CHEBI:77264
ChEBI ASCII Name esomeprazole(1-)
Definition An organic anion resulting from the deprotonation of the hydrogen-bearing nitrogen of the imidazole group of esomeprazole.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C17H18N3O3S
Net Charge -1
Average Mass 344.40900
Monoisotopic Mass 344.107
InChI InChI=1S/C17H18N3O3S/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/t24-/m0/s1
InChIKey MZXXONIZWOBROX-DEOSSOPVSA-N
SMILES COc1ccc2[n-]c(nc2c1)[S@@](=O)Cc1ncc(C)c(OC)c1C
ChEBI Ontology
Outgoing esomeprazole(1−) (CHEBI:77264) is a organic anion (CHEBI:25696)
esomeprazole(1−) (CHEBI:77264) is conjugate base of esomeprazole (CHEBI:50275)
Incoming esomeprazole magnesium (CHEBI:50309) has part esomeprazole(1−) (CHEBI:77264)
esomeprazole (CHEBI:50275) is conjugate acid of esomeprazole(1−) (CHEBI:77264)
IUPAC Name
5-methoxy-2-{(S)-[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfinyl}benzimidazol-1-ide
Last Modified
10 February 2014