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ONTOLOGY REPORT - ANNOTATIONS


Term:Theaflavin-3-gallate
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Accession:CHEBI:136607 term browser browse the term
Synonyms:exact_synonym: (2R,3R)-5,7-Dihydroxy-2-{3,4,5-trihydroxy-6-oxo-8-[(2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]-6H-benzo[7]annulen-1-yl}-3,4-dihydro-2H-chromen-3-yl 3,4,5-trihydroxybenzoate
 related_synonym: Formula=C36H28O16;   InChI=1S/C36H28O16/c37-14-5-20(39)18-10-26(45)34(50-27(18)7-14)12-1-16-17(9-25(44)33(48)30(16)32(47)24(43)2-12)35-29(11-19-21(40)6-15(38)8-28(19)51-35)52-36(49)13-3-22(41)31(46)23(42)4-13/h1-9,26,29,34-35,37-42,44-46,48H,10-11H2,(H,43,47)/t26-,29-,34-,35-/m1/s1;   InChIKey=GPLOTACQBREROW-WQLSNUALSA-N;   SMILES=O1[C@@H]([C@H](OC(=O)C2=CC(O)=C(O)C(O)=C2)CC=3C1=CC(O)=CC3O)C=4C5=CC([C@H]6OC=7C(C[C@H]6O)=C(O)C=C(O)C7)=CC(=O)C(O)=C5C(O)=C(O)C4
 xref: Chemspider:410682


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Term Annotations click to browse term
  CHEBI ontology 227
    chemical entity 227
      molecular entity 227
        polyatomic entity 219
          heteroatomic molecular entity 180
            hydroxides 156
              organic hydroxy compound 118
                hydroxyflavan 0
                  catechin 0
                    Theaflavin-3-gallate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 227
    subatomic particle 227
      composite particle 227
        hadron 227
          baryon 227
            nucleon 227
              atomic nucleus 227
                atom 227
                  main group element atom 220
                    p-block element atom 220
                      carbon group element atom 208
                        carbon atom 207
                          organic molecular entity 207
                            organic molecule 202
                              organic cyclic compound 186
                                organic heterocyclic compound 144
                                  oxacycle 53
                                    benzopyran 12
                                      1-benzopyran 12
                                        flavonoid 5
                                          flavans 0
                                            hydroxyflavan 0
                                              catechin 0
                                                Theaflavin-3-gallate 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.