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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:2-O,3-dimethylflaviolin-7-olate
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Accession:CHEBI:78589 term browser browse the term
Definition:An organic anion that is the conjugate base of 2-O,3-dimethylflaviolin, obtained by deprotonation of the 7-hydroxy group. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Synonyms:exact_synonym: 4-hydroxy-7-methoxy-6-methyl-5,8-dioxo-5,8-dihydronaphthalen-2-olate
 related_synonym: 2-O,3-dimethylflaviolin;   2-methoxy-3-methylflaviolin-7-olate;   Formula=C12H9O5;   InChI=1S/C12H10O5/c1-5-10(15)9-7(11(16)12(5)17-2)3-6(13)4-8(9)14/h3-4,13-14H,1-2H3/p-1;   InChIKey=MMVQTVRCJUHCSV-UHFFFAOYSA-M;   SMILES=COC1=C(C)C(=O)c2c(O)cc([O-])cc2C1=O
 xref: MetaCyc:CPD-16658;   PMID:20937800
 cyclic_relationship: is_conjugate_base_of CHEBI:82611


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19832
    chemical entity 19830
      molecular entity 19830
        ion 16710
          anion 16087
            organic anion 3613
              2-O,3-dimethylflaviolin-7-olate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19832
    subatomic particle 19830
      composite particle 19830
        hadron 19830
          baryon 19830
            nucleon 19830
              atomic nucleus 19830
                atom 19830
                  main group element atom 19780
                    p-block element atom 19780
                      p-block molecular entity 19780
                        carbon group molecular entity 19729
                          organic molecular entity 19725
                            organic ion 9870
                              organic anion 3613
                                2-O,3-dimethylflaviolin-7-olate 0
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