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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:benzquercin
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Accession:CHEBI:135880 term browser browse the term
Synonyms:related_synonym: 3,3',4',5,7-Pentabenzyloxyflavone;   Formula=C50H40O7;   InChI=1S/C50H40O7/c51-48-47-45(55-34-39-22-12-4-13-23-39)29-42(52-31-36-16-6-1-7-17-36)30-46(47)57-49(50(48)56-35-40-24-14-5-15-25-40)41-26-27-43(53-32-37-18-8-2-9-19-37)44(28-41)54-33-38-20-10-3-11-21-38/h1-30H,31-35H2;   InChIKey=CSQNIJRRXIHHAY-UHFFFAOYSA-N;   SMILES=O(CC1=CC=CC=C1)C2=C3C(OC(=C(C3=O)OCC4=CC=CC=C4)C5=CC(OCC6=CC=CC=C6)=C(C=C5)OCC7=CC=CC=C7)=CC(=C2)OCC8=CC=CC=C8;   benzquercine;   parietrope;   quercetin pentabenzyl ether
 xref: CAS:13157-90-9;   Drug_Central:330


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 885
    chemical entity 885
      atom 870
        nonmetal atom 850
          oxygen atom 765
            oxygen molecular entity 765
              flavonoids 39
                flavonoid 33
                  flavones 24
                    benzquercin 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 885
    subatomic particle 870
      composite particle 870
        hadron 870
          baryon 870
            nucleon 870
              atomic nucleus 870
                atom 870
                  main group element atom 860
                    p-block element atom 857
                      carbon group element atom 833
                        carbon atom 832
                          organic molecular entity 832
                            organic molecule 745
                              organic cyclic compound 654
                                organic heterocyclic compound 364
                                  oxacycle 260
                                    benzopyran 119
                                      1-benzopyran 69
                                        flavonoid 33
                                          flavones 24
                                            benzquercin 0
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