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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:(S)-bromacil
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Accession:CHEBI:83660 term browser browse the term
Definition:The (S)-enantiomer of 5-bromo-3-(butan-2-yl)-6-methylpyrimidine-2,4(1H,3H)-dione.
Synonyms:exact_synonym: 5-bromo-3-[(2S)-butan-2-yl]-6-methylpyrimidine-2,4(1H,3H)-dione
 related_synonym: Formula=C9H13BrN2O2;   InChI=1S/C9H13BrN2O2/c1-4-5(2)12-8(13)7(10)6(3)11-9(12)14/h5H,4H2,1-3H3,(H,11,14)/t5-/m0/s1;   InChIKey=CTSLUCNDVMMDHG-YFKPBYRVSA-N;   SMILES=CC[C@H](C)n1c(=O)[nH]c(C)c(Br)c1=O
 cyclic_relationship: is_enantiomer_of CHEBI:83659


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bromacil term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Pde4a phosphodiesterase 4A affects activity ISO bromacil affects the activity of PDE4A protein CTD PMID:21251949 NCBI chr 8:19,690,816...19,753,538
Ensembl chr 8:19,703,290...19,751,961 		JBrowse link
G Pde5a phosphodiesterase 5A affects activity ISO bromacil affects the activity of PDE5 protein CTD PMID:21251949 NCBI chr 2:210,858,515...211,003,480
Ensembl chr 2:210,858,063...210,999,701 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19811
    chemical entity 19840
      molecular entity 19809
        polyatomic entity 19767
          heteroatomic molecular entity 19723
            halide 18642
              organohalogen compound 18484
                organobromine compound 6584
                  5-bromo-3-(butan-2-yl)-6-methylpyrimidine-2,4(1H,3H)-dione 2
                    (S)-bromacil 2
                      bromacil 2
Path 2
Term Annotations click to browse term
  CHEBI ontology 19811
    subatomic particle 19809
      composite particle 19809
        hadron 19840
          baryon 19809
            nucleon 19809
              atomic nucleus 19809
                atom 19809
                  main group element atom 19759
                    p-block element atom 19759
                      carbon group element atom 19708
                        carbon atom 19734
                          organic molecular entity 19705
                            organic molecule 19658
                              organic cyclic compound 19471
                                organic heterocyclic compound 18862
                                  organic heteromonocyclic compound 17772
                                    diazines 13222
                                      pyrimidines 13088
                                        pyrimidone 10500
                                          5-bromo-3-(butan-2-yl)-6-methylpyrimidine-2,4(1H,3H)-dione 2
                                            (S)-bromacil 2
                                              bromacil 2
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