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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.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C17H18N3O3S
Net Charge
-1
Average Mass
344.40900
Monoisotopic Mass
344.10744
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