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ONTOLOGY REPORT - ANNOTATIONS


Term:(-)-DCA-CL
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Accession:CHEBI:132247 term browser browse the term
Definition:A member of the class of 1-benzofurans that is a lignan obtained by cyclodimerisation of ferulic acid.
Synonyms:exact_synonym: (2E)-3-[(2R,3R)-3-formyl-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]prop-2-enoic acid
 related_synonym: (-)-dehydrodiconiferyl acid aldehyde;   Formula=C20H18O7;   InChI=1S/C20H18O7/c1-25-16-9-12(4-5-15(16)22)19-14(10-21)13-7-11(3-6-18(23)24)8-17(26-2)20(13)27-19/h3-10,14,19,22H,1-2H3,(H,23,24)/b6-3+/t14-,19+/m1/s1;   InChIKey=WJCNWNKOLJMKJE-WARYXCEBSA-N;   SMILES=C1=C(C=C2C(=C1OC)O[C@H]([C@@H]2C=O)C3=CC=C(C(=C3)OC)O)/C=C/C(O)=O
 xref: MetaCyc:CPD-17078;   PMID:26362985 "Europe PMC"
 cyclic_relationship: is_conjugate_acid_of CHEBI:131933;   is_enantiomer_of CHEBI:132251


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19669
    role 19613
      chemical role 19128
        antioxidant 14048
          ferulic acid 897
            (-)-DCA-CL 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19669
    subatomic particle 19665
      composite particle 19665
        hadron 19665
          baryon 19665
            nucleon 19665
              atomic nucleus 19665
                atom 19665
                  main group element atom 19545
                    p-block element atom 19545
                      carbon group element atom 19428
                        carbon atom 19420
                          organic molecular entity 19420
                            organic group 18343
                              organic divalent group 18334
                                organodiyl group 18334
                                  carbonyl group 18222
                                    carbonyl compound 18222
                                      carboxylic acid 17923
                                        monocarboxylic acid 17256
                                          alpha,beta-unsaturated monocarboxylic acid 11261
                                            cinnamic acids 2352
                                              hydroxycinnamic acid 1231
                                                monohydroxycinnamic acid 901
                                                  ferulic acids 897
                                                    ferulic acid 897
                                                      (-)-DCA-CL 0
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