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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:methylprednisolone acetate
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Accession:CHEBI:6889 term browser browse the term
Definition:An acetate ester resulting from the formal condensation of the 21-hydroxy function of 6alpha-methylprednisolone compound with acetic acid.
Synonyms:exact_synonym: (6alpha,11beta)-11,17-dihydroxy-6-methyl-3,20-dioxopregna-1,4-dien-21-yl acetate
 related_synonym: 11beta,17,21-Trihydroxy-6alpha-methylpregna-1,4-diene-3,20-dione 21-acetate;   6alpha-Methylprednisolone 21-acetate;   6alpha-Methylprednisolone acetate;   Depo-Methylprednisolone acetate;   Depo-medrol;   Formula=C24H32O6;   InChI=1S/C24H32O6/c1-13-9-16-17-6-8-24(29,20(28)12-30-14(2)25)23(17,4)11-19(27)21(16)22(3)7-5-15(26)10-18(13)22/h5,7,10,13,16-17,19,21,27,29H,6,8-9,11-12H2,1-4H3/t13-,16-,17-,19-,21+,22-,23-,24-/m0/s1;   InChIKey=PLBHSZGDDKCEHR-LFYFAGGJSA-N;   M-Predrol;   Methylprednisolone 21-acetate;   SMILES=C[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(=O)COC(C)=O)[C@@]3(C)C[C@H](O)[C@@H]2[C@@]2(C)C=CC(=O)C=C12
 xref: Beilstein:3176535;   CAS:53-36-1;   Drug_Central:1770;   KEGG:C08179;   KEGG:D00979


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  CHEBI ontology 0
    role 0
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        anti-inflammatory agent 0
          anti-inflammatory drug 0
            methylprednisolone acetate 0
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  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
                                                  6-methylprednisolone 0
                                                    6alpha-methylprednisolone 0
                                                      methylprednisolone acetate 0
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