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ONTOLOGY REPORT - ANNOTATIONS


Term:betamethasone acibutate
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Accession:CHEBI:50894 term browser browse the term
Definition:A fluorinated steroid that has formula C28H37FO7.
Synonyms:exact_synonym: 21-acetoxy-9-fluoro-11beta-hydroxy-16beta-methyl-3,20-dioxopregna-1,4-dien-17-yl 2-methylpropanoate
 related_synonym: 9-Fluoro-11beta,17,21-trihydroxy-16beta-methylpregna-1,4-diene-3,20-dione 21-acetate 17-isobutyrate;   Formula=C28H37FO7;   InChI=1S/C28H37FO7/c1-15(2)24(34)36-28(23(33)14-35-17(4)30)16(3)11-21-20-8-7-18-12-19(31)9-10-25(18,5)27(20,29)22(32)13-26(21,28)6/h9-10,12,15-16,20-22,32H,7-8,11,13-14H2,1-6H3/t16-,20-,21-,22-,25-,26-,27-,28-/m0/s1;   InChIKey=KGNVBESWWSSQAN-QEVRMTOFSA-N;   SMILES=[H][C@@]12C[C@H](C)[C@](OC(=O)C(C)C)(C(=O)COC(C)=O)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])CCC2=CC(=O)C=C[C@]12C;   acibutate de betamethasone;   acibutato de betametasona;   betamethasoni acibutas
 xref: Beilstein:2493686;   CAS:5534-05-4;   DrugBank:DB00443;   Drug_Central:350


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  CHEBI ontology 19758
    role 19705
      application 19359
        anti-asthmatic agent 9173
          betamethasone 24
            betamethasone acibutate 0
Path 2
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  CHEBI ontology 19758
    subatomic particle 19756
      composite particle 19756
        hadron 19756
          baryon 19756
            nucleon 19756
              atomic nucleus 19756
                atom 19756
                  main group element atom 19641
                    p-block element atom 19641
                      carbon group element atom 19532
                        carbon atom 19521
                          organic molecular entity 19521
                            organic group 18428
                              organic divalent group 18419
                                organodiyl group 18419
                                  carbonyl group 18309
                                    carbonyl compound 18309
                                      ketone 15948
                                        oxyketone 8487
                                          alpha-oxyketone 8487
                                            alpha-hydroxy ketone 8487
                                              primary alpha-hydroxy ketone 7450
                                                betamethasone 24
                                                  betamethasone acibutate 0
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