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ONTOLOGY REPORT - ANNOTATIONS


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 "ChemIDplus";   CAS:50892-23-4 "KEGG COMPOUND";   KEGG:C15617;   LINCS:LSM-2015
 xref_mesh: MESH:C006253
 xref: Wikipedia:Pirinixic_Acid


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  CHEBI ontology 19596
    role 19539
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              pirinixic acid 7158
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                                  carbonyl group 18176
                                    carbonyl compound 18176
                                      carboxylic acid 17840
                                        monocarboxylic acid 17169
                                          acetic acid 10571
                                            pirinixic acid 7158
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