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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:bupirimate
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Accession:CHEBI:81952 term browser browse the term
Definition:A member of the class of aminopyrimidines that is 2-ethylaminopyrimidine carrying methyl, butyl and dimethylaminosulfooxy substituents at posiitons 4, 5 and 6 respectively.
Synonyms:related_synonym: 2-Aethylamino-5-butyl-4-yl-dimethylsulfamat;   5-Butyl-2-(ethylamino)-6-methyl-4-pyrimidinyl dimethylsulfamate;   5-Butyl-2-ethylamino-6-methylpyrimidin-4-yl dimethylsulphamate;   5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate;   Dimethylsulfamic acid 5-butyl-2-(ethylamino)-6-methyl-4-pyrimidinyl ester
 xref: AGR:IND44683022;   CAS:41483-43-6
 xref_mesh: MESH:C071704
 xref: PPDB:99;   Patent:CN101617658;   Patent:CN101632364;   Patent:CN101632374;   Patent:CN101647442;   Patent:CN101647443;   Patent:DE3441674;   Patent:GB2112287;   Pesticides:bupirimate;   Reaxys:758056;   kegg.compound:C18776;   pubmed:11271705;   pubmed:11407590;   pubmed:1322478;   pubmed:1333747;   pubmed:20736058;   pubmed:22467459;   pubmed:25035916;   pubmed:7835474;   pubmed:8381343;   wikipedia.en:Bupirimate
 chemrof_formula: C13H24N4O3S
 chemrof_smiles: CCCCc1c(C)nc(NCC)nc1OS(=O)(=O)N(C)C
 chemrof_inchikey: DSKJPMWIHSOYEA-UHFFFAOYSA-N
 chemrof_inchi: InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)


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bupirimate term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Nr1i2 nuclear receptor subfamily 1, group I, member 2 increases activity ISO bupirimate results in increased activity of NR1I2 protein CTD PMID:16565514 PMID:21924250 NCBI chr11:75,965,717...76,006,733
Ensembl chr11:75,965,632...76,002,380 		JBrowse link
G Nr1i3 nuclear receptor subfamily 1, group I, member 3 increases activity ISO bupirimate results in increased activity of NR1I3 protein CTD PMID:21924250 NCBI chr13:86,165,327...86,170,362
Ensembl chr13:86,165,349...86,170,370 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 20874
    role 20844
      application 20572
        pesticide 18454
          antifungal agrochemical 11980
            bupirimate 2
Path 2
Term Annotations click to browse term
  CHEBI ontology 20874
    subatomic particle 20883
      composite particle 20883
        hadron 20872
          baryon 20883
            nucleon 20872
              atomic nucleus 20883
                atom 20872
                  main group element atom 20796
                    p-block element atom 20796
                      carbon group element atom 20712
                        carbon atom 20706
                          organic molecular entity 20706
                            organic molecule 20499
                              organic cyclic compound 20390
                                organic heterocyclic compound 19381
                                  organic heteromonocyclic compound 18004
                                    diazines 13662
                                      pyrimidines 13531
                                        pyrimidine antifungal agent 85
                                          pyrimidine fungicide 82
                                            bupirimate 2
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