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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:3-O-methylgallic acid
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Accession:CHEBI:28647 term browser browse the term
Definition:A member of the class of benzoic acids that is gallic acid in which the phenolic hydroxy group at position 3 is converted into the corresponding methyl ether.
Synonyms:exact_synonym: 3,4-dihydroxy-5-methoxybenzoic acid
 related_synonym: 4,5-Dihydroxy-m-anisic acid;   Formula=C8H8O5;   InChI=1S/C8H8O5/c1-13-6-3-4(8(11)12)2-5(9)7(6)10/h2-3,9-10H,1H3,(H,11,12);   InChIKey=KWCCUYSXAYTNKA-UHFFFAOYSA-N;   SMILES=COc1cc(cc(O)c1O)C(O)=O;   gallic acid 3-methyl ether
 alt_id: CHEBI:1615
 xref: CAS:3934-84-7;   KEGG:C05616
 xref_mesh: MESH:C025525
 xref: Reaxys:2695762
 cyclic_relationship: is_conjugate_acid_of CHEBI:19950


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3-O-methylgallic acid term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Comt catechol-O-methyltransferase increases methylation ISO COMT protein results in increased methylation of 3-O-methylgallic acid 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
      chemical role 19473
        antioxidant 16145
          gallic acid 2733
            3-O-methylgallic acid 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
                            heteroorganic entity 19505
                              organochalcogen compound 19268
                                organooxygen compound 19184
                                  carbon oxoacid 18654
                                    carboxylic acid 18651
                                      aromatic carboxylic acid 12686
                                        benzoic acids 12663
                                          benzoic acid 5503
                                            hydroxybenzoic acid 4978
                                              trihydroxybenzoic acid 2750
                                                gallic acid 2733
                                                  3-O-methylgallic acid 1
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