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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:caffeic acid quinone
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Accession:CHEBI:133316 term browser browse the term
Definition:An alpha,beta-unsaturated monocarboxylic acid that is acrylic acid in which one of the olefinic hydrogens at position 3 has been replaced by a 3,4-dioxocyclohexa-1,5-dien-1-yl group.
Synonyms:exact_synonym: (2E)-3-(3,4-dioxocyclohexa-1,5-dien-1-yl)prop-2-enoic acid
 related_synonym: 3-(2-propenoic acid)-o-benzoquinone;   3-(3,4-dioxocyclohexa-1,5-dien-1-yl)acrylic acid;   Formula=C9H6O4;   InChI=1S/C9H6O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5H,(H,12,13)/b4-2+;   InChIKey=QPYQKHOKNCVKGE-DUXPYHPUSA-N;   SMILES=O=C1C=C(C=CC1=O)/C=C/C(O)=O;   caffeic acid o-quinone;   caffeoquinone
 alt_id: CHEBI:80759
 xref: AGR:IND20384788;   AGR:IND23278687;   AGR:IND87016065;   Chemspider:24785041;   KEGG:C16828;   PMID:10552861;   PMID:15893932;   PMID:2356237;   PMID:7586086;   Reaxys:2718010

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Term Annotations click to browse term
  CHEBI ontology 0
    role 0
      biological role 0
        biochemical role 0
          metabolite 0
            acrylic acid 0
              caffeic acid quinone 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbonyl compound 0
                                    ketone 0
                                      cyclic ketone 0
                                        quinone 0
                                          benzoquinones 0
                                            1,2-benzoquinones 0
                                              caffeic acid quinone 0
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