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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 22441
        role 22425
          application 22049
            food additive 18298
              food acidity regulator 12466
                acetic acid 11522
                  pirinixic acid 7487
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      CHEBI ontology 22441
        subatomic particle 22435
          composite particle 22435
            hadron 22435
              baryon 22435
                nucleon 22435
                  atomic nucleus 22435
                    atom 22435
                      main group element atom 22321
                        p-block element atom 22321
                          carbon group element atom 22125
                            carbon atom 22058
                              organic molecular entity 22058
                                heteroorganic entity 21705
                                  organochalcogen compound 21195
                                    organooxygen compound 21038
                                      carbon oxoacid 19818
                                        carboxylic acid 19814
                                          monocarboxylic acid 19080
                                            acetic acid 11522
                                              pirinixic acid 7487
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