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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:loxoprofen sodium
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Accession:CHEBI:76198 term browser browse the term
Definition:An organic sodium salt having loxoprofen(1-) as the counterion. The parent acid, loxoprofen, is a prodrug that is rapidly converted to its active trans-alcohol metabolite following oral administration.
Synonyms:exact_synonym: sodium 2-{4-[(2-oxocyclopentyl)methyl]phenyl}propanoate
 related_synonym: Formula=C15H17NaO3;   InChI=1S/C15H18O3.Na/c1-10(15(17)18)12-7-5-11(6-8-12)9-13-3-2-4-14(13)16;/h5-8,10,13H,2-4,9H2,1H3,(H,17,18);/q;+1/p-1;   InChIKey=WORCCYVLMMTGFR-UHFFFAOYSA-M;   SMILES=[Na+].CC(C([O-])=O)c1ccc(CC2CCCC2=O)cc1;   loxoprofen sodium salt
 xref: Reaxys:5686164;   Wikipedia:Loxoprofen


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 22178
    role 22194
      application 21744
        anti-inflammatory agent 17331
          anti-inflammatory drug 15203
            non-steroidal anti-inflammatory drug 14432
              loxoprofen sodium 0
                loxoprofen sodium hydrate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22178
    subatomic particle 22170
      composite particle 22170
        hadron 22201
          baryon 22170
            nucleon 22170
              atomic nucleus 22170
                atom 22170
                  main group element atom 22104
                    p-block element atom 22104
                      carbon group element atom 21904
                        carbon atom 21859
                          organic molecular entity 21830
                            organic ion 10063
                              organic anion 3680
                                carboxylic acid anion 2524
                                  monocarboxylic acid anion 1606
                                    oxo monocarboxylic acid anion 0
                                      loxoprofen(1-) 0
                                        loxoprofen sodium 0
                                          loxoprofen sodium hydrate 0
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