CHEBI:75918 - sodium (2-amino-3-benzoylphenyl)acetate

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ChEBI Name sodium (2-amino-3-benzoylphenyl)acetate
ChEBI ID CHEBI:75918
Definition An organic sodium salt having amfenac(1−) as the counterion.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C15H12NNaO3
Net Charge 0
Average Mass 277.25040
Monoisotopic Mass 277.07149
InChI InChI=1S/C15H13NO3.Na/c16-14-11(9-13(17)18)7-4-8-12(14)15(19)10-5-2-1-3-6-10;/h1-8H,9,16H2,(H,17,18);/q;+1/p-1
InChIKey MJAQSCHBMPGJES-UHFFFAOYSA-M
SMILES [Na+].Nc1c(CC([O-])=O)cccc1C(=O)c1ccccc1
Roles Classification
Biological Role(s): cyclooxygenase 2 inhibitor
A cyclooxygenase inhibitor that interferes with the action of cyclooxygenase 2.
cyclooxygenase 1 inhibitor
A cyclooxygenase inhibitor that interferes with the action of cyclooxygenase 1.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing sodium (2-amino-3-benzoylphenyl)acetate (CHEBI:75918) has part amfenac(1−) (CHEBI:75917)
sodium (2-amino-3-benzoylphenyl)acetate (CHEBI:75918) has role cyclooxygenase 1 inhibitor (CHEBI:50630)
sodium (2-amino-3-benzoylphenyl)acetate (CHEBI:75918) has role cyclooxygenase 2 inhibitor (CHEBI:50629)
sodium (2-amino-3-benzoylphenyl)acetate (CHEBI:75918) is a organic sodium salt (CHEBI:38700)
Incoming amfenac sodium hydrate (CHEBI:31202) has part sodium (2-amino-3-benzoylphenyl)acetate (CHEBI:75918)
IUPAC Name
sodium (2-amino-3-benzoylphenyl)acetate
Registry Numbers Types Sources
4283561 Reaxys Registry Number Reaxys
61941-56-8 CAS Registry Number ChemIDplus
Last Modified
14 October 2013