CHEBI:6889 - methylprednisolone acetate

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ChEBI Name methylprednisolone acetate
ChEBI ID CHEBI:6889
Definition An acetate ester resulting from the formal condensation of the 21-hydroxy function of 6α-methylprednisolone compound with acetic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C24H32O6
Net Charge 0
Average Mass 416.50730
Monoisotopic Mass 416.21989
InChI 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
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
Roles Classification
Biological Role(s): hormone
Originally referring to an endogenous compound that is formed in specialized organ or group of cells and carried to another organ or group of cells, in the same organism, upon which it has a specific regulatory function, the term is now commonly used to include non-endogenous, semi-synthetic and fully synthetic analogues of such compounds.
(via steroid hormone )
Application(s): anti-inflammatory drug
A substance that reduces or suppresses inflammation.
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ChEBI Ontology
Outgoing methylprednisolone acetate (CHEBI:6889) has functional parent 6α-methylprednisolone (CHEBI:6888)
methylprednisolone acetate (CHEBI:6889) has role anti-inflammatory drug (CHEBI:35472)
methylprednisolone acetate (CHEBI:6889) is a 11β-hydroxy steroid (CHEBI:35346)
methylprednisolone acetate (CHEBI:6889) is a 17α-hydroxy steroid (CHEBI:35342)
methylprednisolone acetate (CHEBI:6889) is a 20-oxo steroid (CHEBI:36885)
methylprednisolone acetate (CHEBI:6889) is a 3-oxo-Δ1,Δ4-steroid (CHEBI:77166)
methylprednisolone acetate (CHEBI:6889) is a acetate ester (CHEBI:47622)
methylprednisolone acetate (CHEBI:6889) is a glucocorticoid (CHEBI:24261)
methylprednisolone acetate (CHEBI:6889) is a steroid ester (CHEBI:47880)
methylprednisolone acetate (CHEBI:6889) is a tertiary α-hydroxy ketone (CHEBI:139592)
IUPAC Name
(6α,11β)-11,17-dihydroxy-6-methyl-3,20-dioxopregna-1,4-dien-21-yl acetate
Synonyms Sources
11beta,17,21-Trihydroxy-6alpha-methylpregna-1,4-diene-3,20-dione 21-acetate KEGG COMPOUND
6alpha-Methylprednisolone 21-acetate KEGG COMPOUND
6alpha-Methylprednisolone acetate ChemIDplus
Depo-medrol ChemIDplus
Depo-Methylprednisolone acetate ChemIDplus
M-Predrol KEGG COMPOUND
Methylprednisolone 21-acetate ChemIDplus
Methylprednisolone acetate ChemIDplus
Methylprednisolone acetate KEGG COMPOUND
Manual Xrefs Databases
1770 DrugCentral
C08179 KEGG COMPOUND
D00979 KEGG DRUG
View more database links
Registry Numbers Types Sources
3176535 Beilstein Registry Number Beilstein
53-36-1 CAS Registry Number KEGG COMPOUND
53-36-1 CAS Registry Number ChemIDplus
Last Modified
07 February 2018