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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:stipitaton-4-olate
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Accession:CHEBI:57775 term browser browse the term
Definition:Conjugate base of stipitatonic acid arising from selective deprotonation of the 4-hydroxy group; major species at pH 7.3.
Synonyms:exact_synonym: 7-hydroxy-1,3,6-trioxo-3,6-dihydro-1H-cyclohepta[c]furan-4-olate
 related_synonym: 7-hydroxy-1,3,6-trioxo-1H,3H,6H-cyclohepta[c]furan-4-olate;   Formula=C9H3O6;   InChI=1S/C9H4O6/c10-4-1-3-7(6(12)2-5(4)11)9(14)15-8(3)13/h1-2,12H,(H,10,11)/p-1;   InChIKey=IECSWTFJOUGQFO-UHFFFAOYSA-M;   SMILES=Oc1cc2C(=O)OC(=O)c2c([O-])cc1=O;   stipitatonate
 cyclic_relationship: is_conjugate_base_of CHEBI:16445


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19811
    chemical entity 19840
      molecular entity 19809
        ion 16709
          anion 16070
            organic anion 3609
              stipitaton-4-olate 0
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
                      p-block molecular entity 19759
                        carbon group molecular entity 19708
                          organic molecular entity 19705
                            organic ion 9854
                              organic anion 3609
                                stipitaton-4-olate 0
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