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ONTOLOGY REPORT - ANNOTATIONS


Term:hydrocortisone caproate
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Accession:CHEBI:31676 term browser browse the term
Definition:The 21-O-hexanoyl derivative of hydrocortisone.
Synonyms:exact_synonym: 11beta,17-dihydroxy-3,20-dioxopregn-4-en-21-yl hexanoate
 related_synonym: 11beta,17,21-Trihydroxypregn-4-ene-3,20-dione 21-hexanoate;   Formula=C27H40O6;   InChI=1S/C27H40O6/c1-4-5-6-7-23(31)33-16-22(30)27(32)13-11-20-19-9-8-17-14-18(28)10-12-25(17,2)24(19)21(29)15-26(20,27)3/h14,19-21,24,29,32H,4-13,15-16H2,1-3H3/t19-,20-,21-,24+,25-,26-,27-/m0/s1;   InChIKey=XZSVYVIYKBHVMV-FOMYWIRZSA-N;   SMILES=[H][C@@]12CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])[C@@H](O)C[C@@]1(C)[C@@]2([H])CC[C@]1(O)C(=O)COC(=O)CCCCC;   [2-(11,17-Dihydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-ethyl]hexanoate
 xref: Beilstein:3020664 "Beilstein";   CAS:3593-96-2 "ChemIDplus";   CAS:3593-96-2 "KEGG COMPOUND";   KEGG:C13422;   KEGG:D09796;   LIPID_MAPS_instance:LMST02030129 "LIPID MAPS"


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  CHEBI ontology 19764
    role 19711
      application 19362
        anti-inflammatory agent 14957
          anti-inflammatory drug 13608
            cortisol 154
              hydrocortisone caproate 0
Path 2
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  CHEBI ontology 19764
    subatomic particle 19762
      composite particle 19762
        hadron 19762
          baryon 19762
            nucleon 19762
              atomic nucleus 19762
                atom 19762
                  main group element atom 19646
                    p-block element atom 19646
                      carbon group element atom 19540
                        carbon atom 19529
                          organic molecular entity 19529
                            organic group 18432
                              organic divalent group 18423
                                organodiyl group 18423
                                  carbonyl group 18311
                                    carbonyl compound 18311
                                      ketone 15925
                                        oxyketone 8483
                                          alpha-oxyketone 8483
                                            alpha-hydroxy ketone 8483
                                              primary alpha-hydroxy ketone 7444
                                                cortisol 154
                                                  cortisol ester 0
                                                    hydrocortisone caproate 0
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