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ONTOLOGY REPORT - ANNOTATIONS


Term:(-)-epicatechin-3-O-gallate
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Accession:CHEBI:70255 term browser browse the term
Definition:A gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3R)-hydroxy group of epicatechin. A natural product found in Parapiptadenia rigida.
Synonyms:exact_synonym: [(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
 related_synonym: (-)-cis-3,3',4',5,7-pentahydroxyflavane 3-gallate;   3-O-galloylepicatechin;   3-gallate(-)-epicatechol;   ECG;   Formula=C22H18O10;   InChI=1S/C22H18O10/c23-11-6-14(25)12-8-19(32-22(30)10-4-16(27)20(29)17(28)5-10)21(31-18(12)7-11)9-1-2-13(24)15(26)3-9/h1-7,19,21,23-29H,8H2/t19-,21-/m1/s1;   InChIKey=LSHVYAFMTMFKBA-TZIWHRDSSA-N;   SMILES=Oc1cc(O)c2C[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](Oc2c1)c1ccc(O)c(O)c1;   Teatannin
 xref: AGR:IND43993834 "Europe PMC";   CAS:1257-08-5 "ChemIDplus";   HMDB:HMDB0037944;   LINCS:LSM-3115;   PMID:18560275 "Europe PMC";   PMID:21080642 "Europe PMC";   Reaxys:65603 "Reaxys";   Wikipedia:Epicatechin_gallate


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Term Annotations click to browse term
  CHEBI ontology 19734
    role 19680
      biological role 19678
        biochemical role 19177
          metabolite 19147
            (-)-epicatechin-3-O-gallate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19734
    subatomic particle 19730
      composite particle 19730
        hadron 19730
          baryon 19730
            nucleon 19730
              atomic nucleus 19730
                atom 19730
                  main group element atom 19614
                    p-block element atom 19614
                      carbon group element atom 19506
                        carbon atom 19500
                          organic molecular entity 19500
                            organic group 18414
                              organic divalent group 18406
                                organodiyl group 18406
                                  carbonyl group 18295
                                    carbonyl compound 18295
                                      carboxylic acid 17963
                                        aromatic carboxylic acid 10743
                                          benzoic acids 10709
                                            benzoic acid 3483
                                              hydroxybenzoic acid 2857
                                                trihydroxybenzoic acid 2265
                                                  gallic acid 2246
                                                    gallate ester 2150
                                                      (-)-epicatechin-3-O-gallate 0
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