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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:pirinixic acid
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Accession:CHEBI:32509 term browser browse the term
Definition:An aryl sulfide that has formula C14H14ClN3O2S.
Synonyms:exact_synonym: ({4-chloro-6-[(2,3-dimethylphenyl)amino]pyrimidin-2-yl}sulfanyl)acetic acid
 related_synonym: ((4-Chloro-6-((2,3-dimethylphenyl)amino)-2-pyrimidinyl)thio)acetic acid;   (4-Chloro-6-(2,3-xylidino)-2-pyrimidinylthio)acetic acid;   Formula=C14H14ClN3O2S;   InChI=1S/C14H14ClN3O2S/c1-8-4-3-5-10(9(8)2)16-12-6-11(15)17-14(18-12)21-7-13(19)20/h3-6H,7H2,1-2H3,(H,19,20)(H,16,17,18);   InChIKey=SZRPDCCEHVWOJX-UHFFFAOYSA-N;   SMILES=Cc1cccc(Nc2cc(Cl)nc(SCC(O)=O)n2)c1C;   WY-14,643
 xref: CAS:50892-23-4;   KEGG:C15617;   LINCS:LSM-2015
 xref_mesh: MESH:C006253
 xref: Wikipedia:Pirinixic_Acid


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    Path 1
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      CHEBI ontology 19921
        role 19893
          application 19734
            food additive 16198
              food acidity regulator 11984
                acetic acid 11091
                  pirinixic acid 7180
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      CHEBI ontology 19921
        subatomic particle 19919
          composite particle 19919
            hadron 19919
              baryon 19919
                nucleon 19919
                  atomic nucleus 19919
                    atom 19919
                      main group element atom 19865
                        p-block element atom 19865
                          carbon group element atom 19804
                            carbon atom 19801
                              organic molecular entity 19801
                                heteroorganic entity 19558
                                  organochalcogen compound 19317
                                    organooxygen compound 19233
                                      carbon oxoacid 18695
                                        carboxylic acid 18692
                                          monocarboxylic acid 18028
                                            acetic acid 11091
                                              pirinixic acid 7180
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