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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:brequinar sodium
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Accession:CHEBI:177871 term browser browse the term
Definition:An organic sodium salt of brequinar.
Synonyms:exact_synonym: sodium 6-fluoro-2-(2'-fluoro[biphenyl]-4-yl)-3-methylquinoline-4-carboxylate
 related_synonym: 6-fluoro-2-(2'-fluoro-1,1'-biphenyl-4-yl)-3-methyl-4-quinoline-carboxylic acid sodium salt;   DUP-785;   Formula=C23H14F2NO2.Na;   InChI=1S/C23H15F2NO2.Na/c1-13-21(23(27)28)18-12-16(24)10-11-20(18)26-22(13)15-8-6-14(7-9-15)17-4-2-3-5-19(17)25;/h2-12H,1H3,(H,27,28);/q;+1/p-1;   InChIKey=PZOHOALJQOFNTB-UHFFFAOYSA-M;   NSC-368390;   SMILES=[Na+].CC1=C(C([O-])=O)C2=C(C=CC(F)=C2)N=C1C1=CC=C(C=C1)C1=CC=CC=C1F;   brequinar sodium salt;   sodium 6-fluoro-2-(2'-fluoro[1,1'-biphenyl]-4-yl)-3-methylquinoline-4-carboxylate
 xref: CAS:96201-88-6;   Chemspider:51421;   DrugBank:DBSALT002498;   KEGG:D03154;   PMID:1599514;   PMID:1617622;   PMID:1739622;   PMID:2078489;   PMID:2153375;   PMID:2164443;   PMID:2306706;   PMID:2306795;   PMID:2369734;   PMID:2386542;   PMID:2546667;   PMID:2558540;   PMID:2591433;   PMID:2632251;   PMID:2743343;   PMID:2822596;   PMID:2840910;   PMID:28928900;   PMID:3019518;   PMID:30458345;   PMID:30663496;   PMID:31132976;   PMID:3220087;   PMID:32525770;   PMID:33416466;   PMID:3409452;   PMID:7492488;   PMID:8438444;   PMID:8499153;   PMID:8623481;   PMID:9552330;   PMID:9723457;   PMID:9740540


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Term Annotations click to browse term
  CHEBI ontology 19874
    role 19844
      biological role 19842
        biochemical role 19549
          antimetabolite 10283
            brequinar sodium 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19874
    subatomic particle 19872
      composite particle 19872
        hadron 19872
          baryon 19872
            nucleon 19872
              atomic nucleus 19872
                atom 19872
                  main group element atom 19811
                    p-block element atom 19811
                      carbon group element atom 19751
                        carbon atom 19748
                          organic molecular entity 19748
                            organic ion 11443
                              organic anion 6849
                                carboxylic acid anion 2494
                                  monocarboxylic acid anion 1605
                                    quinolinemonocarboxylate 0
                                      brequinar(1-) 0
                                        brequinar sodium 0
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