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ONTOLOGY REPORT - ANNOTATIONS


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monocarboxylic acid that is acrylic acid in which one of the olefinic hydrogens at position 3 has been replaced by a 3,4-dioxocyclohexa-1,5-dien-1-yl group.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 19790
    role 19738
      biological role 19737
        biochemical role 19232
          metabolite 19208
            acrylic acid 3844
              caffeic acid quinone 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19790
    subatomic particle 19788
      composite particle 19788
        hadron 19788
          baryon 19788
            nucleon 19788
              atomic nucleus 19788
                atom 19788
                  main group element atom 19674
                    p-block element atom 19674
                      carbon group element atom 19572
                        carbon atom 19561
                          organic molecular entity 19561
                            organic group 18475
                              organic divalent group 18468
                                organodiyl group 18468
                                  carbonyl group 18366
                                    carbonyl compound 18366
                                      ketone 16011
                                        cyclic ketone 13487
                                          quinone 8271
                                            benzoquinones 591
                                              1,2-benzoquinones 2
                                                caffeic acid quinone 0
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