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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:4-o-Galloylbergenin
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Accession:CHEBI:81148 term browser browse the term
Definition:A 16-oxo steroid that has formula C21H20O13.
Synonyms:related_synonym: Formula=C21H20O13;   InChI=1S/C21H20O13/c1-31-16-10(25)4-7-12(15(16)28)17-19(34-21(7)30)18(14(27)11(5-22)32-17)33-20(29)6-2-8(23)13(26)9(24)3-6/h2-4,11,14,17-19,22-28H,5H2,1H3;   InChIKey=QKSHSFQTWCKTFV-UHFFFAOYSA-N;   SMILES=COc1c(O)cc2C(=O)OC3C(OC(=O)c4cc(O)c(O)c(O)c4)C(O)C(CO)OC3c2c1O
 xref: KEGG:C17514


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19767
    chemical entity 19767
      group 19686
        inorganic group 19168
          oxo group 18505
            organic oxo compound 18505
              carbonyl compound 18505
                ketone 16832
                  oxo steroid 9721
                    16-oxo steroid 8
                      4-o-Galloylbergenin 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19767
    subatomic particle 19766
      composite particle 19766
        hadron 19766
          baryon 19766
            nucleon 19766
              atomic nucleus 19766
                atom 19766
                  main group element atom 19657
                    p-block element atom 19657
                      carbon group element atom 19573
                        carbon atom 19563
                          organic molecular entity 19563
                            organic group 18599
                              organic divalent group 18590
                                organodiyl group 18590
                                  carbonyl group 18505
                                    carbonyl compound 18505
                                      ketone 16832
                                        oxo steroid 9721
                                          16-oxo steroid 8
                                            4-o-Galloylbergenin 0
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