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ONTOLOGY REPORT - ANNOTATIONS


Term:2-hydroxyibuprofen
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Accession:CHEBI:133197 term browser browse the term
Definition:A hydroxy monocarboxylic acid that is ibuprofen in which the methine proton on the isobutyl group has been replaced by a hydroxy group.
Synonyms:exact_synonym: 2-[4-(2-hydroxy-2-methylpropyl)phenyl]propanoic acid
 related_synonym: 2,4'-(2-Hydroxy-2-methylpropyl)phenylpropionic acid;   Formula=C13H18O3;   Hydroxyibuprofen;   Ibuprofen OH;   InChI=1S/C13H18O3/c1-9(12(14)15)11-6-4-10(5-7-11)8-13(2,3)16/h4-7,9,16H,8H2,1-3H3,(H,14,15);   InChIKey=UJHKVYPPCJBOSG-UHFFFAOYSA-N;   SMILES=C=1C=C(C=CC1C(C(=O)O)C)CC(O)(C)C
 xref: CAS:51146-55-5 "ChemIDplus";   HMDB:HMDB0060920;   PMID:21079932 "Europe PMC";   Reaxys:3051852 "Reaxys"


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Term Annotations click to browse term
  CHEBI ontology 19764
    role 19711
      biological role 19710
        biochemical role 19210
          metabolite 19184
            xenobiotic metabolite 13867
              human xenobiotic metabolite 13065
                drug metabolite 4395
                  2-hydroxyibuprofen 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19764
    subatomic particle 19762
      composite particle 19762
        hadron 19762
          baryon 19762
            nucleon 19762
              atomic nucleus 19762
                atom 19762
                  main group element atom 19646
                    p-block element atom 19646
                      carbon group element atom 19540
                        carbon atom 19529
                          organic molecular entity 19529
                            organic group 18432
                              organic divalent group 18423
                                organodiyl group 18423
                                  carbonyl group 18311
                                    carbonyl compound 18311
                                      carboxylic acid 17978
                                        hydroxy carboxylic acid 3597
                                          hydroxy monocarboxylic acid 3597
                                            2-hydroxyibuprofen 0
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