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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:4-chlorocatechol
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Accession:CHEBI:27772 term browser browse the term
Definition:A chlorocatechol that is catechol substituted by a chloro group at position 4.
Synonyms:related_synonym: 4-chloro-1,2-benzenediol;   4-chlorobenzene-1,2-diol;   4-chloropyrocatechol;   Formula=C6H5ClO2;   InChI=1S/C6H5ClO2/c7-4-1-2-5(8)6(9)3-4/h1-3,8-9H;   InChIKey=WWOBYPKUYODHDG-UHFFFAOYSA-N;   SMILES=Oc1ccc(Cl)cc1O
 alt_id: CHEBI:1806;   CHEBI:20338
 xref: CAS:2138-22-9;   Gmelin:602391;   HMDB:HMDB0041810;   KEGG:C02375
 xref_mesh: MESH:C038861
 xref: MetaCyc:CPD-9152;   PDBeChem:4CL;   PMID:23261399;   PMID:24057966;   PMID:24064298;   Reaxys:1907691;   UM-BBD_compID:c0296


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4-chlorocatechol term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Comt catechol-O-methyltransferase increases methylation ISO
EXP		 COMT protein results in increased methylation of 4-chlorocatechol CTD PMID:11160877 NCBI chr11:82,568,052...82,587,642
Ensembl chr11:82,568,025...82,587,642 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19874
    role 19844
      biological role 19842
        biochemical role 19549
          metabolite 19537
            xenobiotic metabolite 16158
              bacterial xenobiotic metabolite 4184
                4-chlorocatechol 1
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 molecule 19700
                              organic cyclic compound 19490
                                carbocyclic compound 18579
                                  benzenoid aromatic compound 18003
                                    benzenes 17868
                                      chlorobenzenes 15043
                                        chlorocatechol 2
                                          4-chlorocatechol 1
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