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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:tolmetin sodium dihydrate
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Accession:CHEBI:72014 term browser browse the term
Definition:An organic sodium salt that is the dihydrate form of tolmetin sodium. Used as a nonselective nonsteroidal anti-inflammatory drug.
Synonyms:exact_synonym: sodium [1-methyl-5-(4-methylbenzoyl)-1H-pyrrol-2-yl]acetate--water (1/2)
 related_synonym: Formula=C15H18NNaO5;   InChI=1S/C15H15NO3.Na.2H2O/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);;2*1H2/q;+1;;/p-1;   InChIKey=QQILXENAYPUNEA-UHFFFAOYSA-M;   SMILES=O.O.[Na+].Cc1ccc(cc1)C(=O)c1ccc(CC([O-])=O)n1C;   Sodium 1-methyl-5-p-toluoylpyrrole-2-acetate dihydrate;   Tolectin;   Tolmetin sodium;   Tolumetin sodium dihydrate
 xref: CAS:64490-92-2;   DrugBank:DB00500;   KEGG:D00158;   PMID:1370766;   PMID:14999740;   PMID:16414623;   PMID:16414675;   PMID:19505209;   PMID:20582193;   PMID:2094421;   PMID:21601625;   PMID:2836323;   PMID:300118;   PMID:3881125;   PMID:405018;   PMID:470891;   PMID:535831;   PMID:61224;   PMID:621259;   PMID:6350376;   PMID:6686452;   PMID:7002482;   PMID:7248666;   PMID:7359312;   PMID:7428434;   PMID:8277771;   Patent:US4255335;   Reaxys:13339052;   Wikipedia:Tolmetin_sodium


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Path 1
Term Annotations click to browse term
  CHEBI ontology 400
    role 400
      application 354
        anti-inflammatory agent 30
          anti-inflammatory drug 20
            non-steroidal anti-inflammatory drug 10
              tolmetin sodium dihydrate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 400
    subatomic particle 400
      composite particle 400
        hadron 400
          baryon 400
            nucleon 400
              atomic nucleus 400
                atom 400
                  main group element atom 393
                    p-block element atom 393
                      carbon group element atom 381
                        carbon atom 380
                          organic molecular entity 380
                            organic ion 18
                              organic anion 7
                                carboxylic acid anion 5
                                  monocarboxylic acid anion 3
                                    tolmetin(1-) 0
                                      tolmetin sodium 0
                                        tolmetin sodium dihydrate 0
paths to the root