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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:aceclofenac
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Accession:CHEBI:31159 term browser browse the term
Definition:A monocarboxylic acid that is the carboxymethyl ester of diclofenac. A non-steroidal anti-inflammatory drug related to diclofenac, it is used in the management of osteoarthritis, rheumatoid arthritis, and ankylosing spondylitis.
Synonyms:exact_synonym: (2-{2-[(2,6-dichlorophenyl)amino]phenyl}acetoxy)acetic acid
 related_synonym: 2-[(2,6-dichlorophenyl)amino]benzeneacetic acid carboxymethyl ester;   2-[(2,6-dichlorophenyl)amino]phenylacetoxyacetic acid;   Cincofen;   Clanza;   Formula=C16H13Cl2NO4;   Hifenac;   InChI=1S/C16H13Cl2NO4/c17-11-5-3-6-12(18)16(11)19-13-7-2-1-4-10(13)8-15(22)23-9-14(20)21/h1-7,19H,8-9H2,(H,20,21);   InChIKey=MNIPYSSQXLZQLJ-UHFFFAOYSA-N;   PR-82/3;   SMILES=OC(=O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl;   aceclofenaco;   aceclofenacum;   glycolic acid [o-(2,6-dichloroanilino)phenyl]acetate ester
 xref: CAS:89796-99-6;   Drug_Central:43;   KEGG:D01545;   LINCS:LSM-5762
 xref_mesh: MESH:C056498
 xref: PMID:11511027;   PMID:22807412;   PMID:23261744;   PMID:23944964;   Patent:ES8404783;   Patent:US4548952;   Reaxys:4884476;   Wikipedia:Aceclofenac


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 5052
    role 5044
      biological role 5016
        xenobiotic 156
          diclofenac 0
            aceclofenac 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 5052
    subatomic particle 5043
      composite particle 5043
        hadron 5071
          baryon 5043
            nucleon 5043
              atomic nucleus 5043
                atom 5043
                  main group element atom 5013
                    p-block element atom 5010
                      carbon group element atom 4927
                        carbon atom 4954
                          organic molecular entity 4926
                            heteroorganic entity 4768
                              organochalcogen compound 4730
                                organooxygen compound 4692
                                  carbon oxoacid 368
                                    carboxylic acid 364
                                      monocarboxylic acid 206
                                        acetic acid 55
                                          phenylacetic acid 0
                                            diclofenac 0
                                              aceclofenac 0
paths to the root