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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)-prednisolone
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Accession:CHEBI:180920 term browser browse the term
Definition:A glucocorticoid that is prednisolone in which a double bond is introduced at position 6. It is a metabolite of prednisolone found in human urine.
Synonyms:exact_synonym: 11beta,17,21-trihydroxypregna-1,4,6-triene-3,20-dione
 related_synonym: (1R,3aS,3bS,9aR,9bS,10S,11aS)-1,10-dihydroxy-1-(hydroxyacetyl)-9a,11a-dimethyl-1,2,3,3a,3b,9a,9b,10,11,11a-decahydro-7H-cyclopenta[a]phenanthren-7-one;   6,7-dehydro-prednisolone;   6,7-dehydroprednisolone;   6-dehydro prednisolone;   Delta(6)-PRED;   Formula=C21H26O5;   InChI=1S/C21H26O5/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/h3-5,7,9,14-16,18,22,24,26H,6,8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1;   InChIKey=WFFSJFFZKKRVOE-VWUMJDOOSA-N;   SMILES=[H][C@@]12CC[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]1([H])[C@@]2([H])C=CC2=CC(=O)C=C[C@]12C;   delta6-prednisolone
 xref: CAS:2427-64-7;   PMID:25800201;   PMID:660591

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  CHEBI ontology 0
    role 0
      biological role 0
        xenobiotic 0
          prednisolone 0
            Delta(6)-prednisolone 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbonyl compound 0
                                    ketone 0
                                      oxo steroid 0
                                        3-oxo steroid 0
                                          3-oxo-Delta(4) steroid 0
                                            progesterone 0
                                              Delta(1)-progesterone 0
                                                prednisolone 0
                                                  Delta(6)-prednisolone 0
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