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ONTOLOGY REPORT - ANNOTATIONS


Term:9-fluoro-11beta,17,21-trihydroxy-2alpha-methylpregn-4-ene-3,20-dione 21-acetate
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Accession:CHEBI:79771 term browser browse the term
Definition:A steroid ester that is pregn-4-en-21-yl acetate substituted by a fluoro group at position 9, hydroxy groups at positions 11 and 17 and oxo groups at positions 3 and 20 respectively.
Synonyms:exact_synonym: 9-fluoro-11beta,17-dihydroxy-2alpha-methyl-3,20-dioxopregn-4-en-21-yl acetate
 related_synonym: 9-fluoro-17-hydroxy-2alpha-methylcorticosterone 21-acetate;   Formula=C24H33FO6;   InChI=1S/C24H33FO6/c1-13-10-21(3)15(9-18(13)27)5-6-17-16-7-8-23(30,20(29)12-31-14(2)26)22(16,4)11-19(28)24(17,21)25/h9,13,16-17,19,28,30H,5-8,10-12H2,1-4H3/t13-,16+,17+,19+,21+,22+,23+,24+/m1/s1;   InChIKey=OGDQCSZNJSAJKD-IJUIUGIXSA-N;   SMILES=C[C@@H]1C[C@@]2(C)C(CC[C@H]3[C@@H]4CC[C@](O)(C(=O)COC(C)=O)[C@@]4(C)C[C@H](O)[C@]23F)=CC1=O
 xref: CAS:1524-87-4 "ChemIDplus";   KEGG:C15269;   Reaxys:3182026 "Reaxys"


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Term Annotations click to browse term
  CHEBI ontology 19716
    chemical entity 19714
      group 19628
        organic group 18407
          3-oxo-Delta(4)-steroid group 7910
            3-oxo-Delta(4) steroid 7910
              9-fluoro-11beta,17,21-trihydroxy-2alpha-methylpregn-4-ene-3,20-dione 21-acetate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19716
    subatomic particle 19712
      composite particle 19712
        hadron 19712
          baryon 19712
            nucleon 19712
              atomic nucleus 19712
                atom 19712
                  main group element atom 19598
                    p-block element atom 19598
                      carbon group element atom 19486
                        carbon atom 19480
                          organic molecular entity 19480
                            organic group 18407
                              organic divalent group 18397
                                organodiyl group 18397
                                  carbonyl group 18285
                                    carbonyl compound 18285
                                      ketone 15909
                                        oxyketone 8447
                                          alpha-oxyketone 8447
                                            alpha-hydroxy ketone 8447
                                              tertiary alpha-hydroxy ketone 8262
                                                9-fluoro-11beta,17,21-trihydroxy-2alpha-methylpregn-4-ene-3,20-dione 21-acetate 0
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