CHEBI:9619 - tolmetin sodium

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ChEBI Name tolmetin sodium
ChEBI ID CHEBI:9619
Definition An organic sodium salt that is the monosodium salt of tolmetin. Used in the form of its dihydrate as a nonselective nonsteroidal anti-inflammatory drug.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C15H14NNaO3
Net Charge 0
Average Mass 279.26630
Monoisotopic Mass 279.08714
InChI InChI=1S/C15H15NO3.Na/c1-10-3-5-11(6-4-10)15(19)13-8-7-12(16(13)2)9-14(17)18;/h3-8H,9H2,1-2H3,(H,17,18);/q;+1/p-1
InChIKey QGUALMNFRILWRA-UHFFFAOYSA-M
SMILES [Na+].Cc1ccc(cc1)C(=O)c1ccc(CC([O-])=O)n1C
Roles Classification
Biological Role(s): EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor
A compound or agent that combines with cyclooxygenases (EC 1.14.99.1) and thereby prevents its substrate-enzyme combination with arachidonic acid and the formation of icosanoids, prostaglandins, and thromboxanes.
Application(s): non-steroidal anti-inflammatory drug
An anti-inflammatory drug that is not a steroid. In addition to anti-inflammatory actions, non-steroidal anti-inflammatory drugs have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins.
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ChEBI Ontology
Outgoing tolmetin sodium (CHEBI:9619) has part tolmetin(1−) (CHEBI:72213)
tolmetin sodium (CHEBI:9619) has role EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor (CHEBI:35544)
tolmetin sodium (CHEBI:9619) has role non-steroidal anti-inflammatory drug (CHEBI:35475)
tolmetin sodium (CHEBI:9619) is a organic sodium salt (CHEBI:38700)
Incoming tolmetin sodium dihydrate (CHEBI:72014) has part tolmetin sodium (CHEBI:9619)
IUPAC Name
sodium [1-methyl-5-(4-methylbenzoyl)-1H-pyrrol-2-yl]acetate
Synonyms Sources
Sodium 1-methyl-5-(4-methylbenzoyl)-1H-pyrrole-2-acetate ChemIDplus
Tolmetin sodium anhydrous ChemIDplus
Manual Xrefs Databases
C02328 KEGG COMPOUND
DB00500 DrugBank
Tolmetin_sodium Wikipedia
US4349563 Patent
WO2004005309 Patent
WO2009072139 Patent
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Registry Numbers Types Sources
35711-34-3 CAS Registry Number ChemIDplus
4626313 Reaxys Registry Number Reaxys
64490-92-2 CAS Registry Number KEGG COMPOUND
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Last Modified
06 February 2013