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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:Delta(6)-prednisone
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Accession:CHEBI:180928 term browser browse the term
Definition:A glucocorticoid that is prednisone in which a double bond is introduced at position 6. It is a metabolite of prednisone found in human urine.
Synonyms:exact_synonym: 17,21-dihydroxypregna-1,4,6-triene-3,11,20-trione
 related_synonym: (1R,3aS,3bS,9aR,9bS,11aS)-1-hydroxy-1-(hydroxyacetyl)-9a,11a-dimethyl-2,3,3a,3b,9a,9b,11,11a-octahydro-1H-cyclopenta[a]phenanthrene-7,10-dione;   Formula=C21H24O5;   InChI=1S/C21H24O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h3-5,7,9,14-15,18,22,26H,6,8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1;   InChIKey=GEGKXSCVRMKKIM-ZPOLXVRWSA-N;   SMILES=[H][C@@]12CC[C@](O)(C(=O)CO)[C@@]1(C)CC(=O)[C@@]1([H])[C@@]2([H])C=CC2=CC(=O)C=C[C@]12C
 xref: PMID:25800201


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Term Annotations click to browse term
  CHEBI ontology 19880
    role 19850
      application 19695
        anti-inflammatory agent 16672
          anti-inflammatory drug 14964
            prednisone 62
              Delta(6)-prednisone 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19880
    subatomic particle 19878
      composite particle 19878
        hadron 19878
          baryon 19878
            nucleon 19878
              atomic nucleus 19878
                atom 19878
                  main group element atom 19817
                    p-block element atom 19817
                      carbon group element atom 19757
                        carbon atom 19754
                          organic molecular entity 19754
                            heteroorganic entity 19512
                              organochalcogen compound 19275
                                organooxygen compound 19191
                                  carbonyl compound 18914
                                    ketone 17263
                                      oxo steroid 10532
                                        3-oxo steroid 9922
                                          3-oxo-Delta(1) steroid 5224
                                            3-oxo-Delta(1),Delta(4)-steroid 5224
                                              prednisone 62
                                                Delta(6)-prednisone 0
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