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CHEBI:78354 - fluorometholone acetate

ChEBI IDCHEBI:78354
ChEBI Namefluorometholone acetate
Stars
DefinitionA steroid ester resulting from the formal condensation of the 17-hydroxy function of fluorometholone with acetic acid. Used in the treatment of steroid responsive inflammatory conditions of the palpebral and bulbar conjunctiva, cornea, and anterior segment of the eye.
Secondary ChEBI IDCHEBI:34765
Last Modified22 February 2017
Submittertmorrison
DownloadsMolfile
FormulaC24H31FO5
Net Charge0
Average Mass418.505
Monoisotopic Mass418.21555
SMILES[H][C@@]12CC[C@](OC(C)=O)(C(C)=O)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])C[C@H](C)C2=CC(=O)C=C[C@@]21C
InChIInChI=1S/C24H31FO5/c1-13-10-19-17-7-9-23(14(2)26,30-15(3)27)22(17,5)12-20(29)24(19,25)21(4)8-6-16(28)11-18(13)21/h6,8,11,13,17,19-20,29H,7,9-10,12H2,1-5H3/t13-,17-,19-,20-,21-,22-,23-,24-/m0/s1
InChIKeyYRFXGQHBPBMFHW-SBTZIJSASA-N
Wikipedia
Roles Classification
Biological Role:
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.
Application:
anti-inflammatory drug  A substance that reduces or suppresses inflammation.
ChEBI Ontology
Outgoing Relation(s)
fluorometholone acetate (CHEBI:78354) has functional parent fluorometholone (CHEBI:31625)
fluorometholone acetate (CHEBI:78354) has functional parent Δ1-progesterone (CHEBI:34073)
fluorometholone acetate (CHEBI:78354) has role anti-inflammatory drug (CHEBI:35472)
fluorometholone acetate (CHEBI:78354) is a 11β-hydroxy steroid (CHEBI:35346)
fluorometholone acetate (CHEBI:78354) is a 20-oxo steroid (CHEBI:36885)
fluorometholone acetate (CHEBI:78354) is a 3-oxo-Δ1,Δ4-steroid (CHEBI:77166)
fluorometholone acetate (CHEBI:78354) is a acetate ester (CHEBI:47622)
fluorometholone acetate (CHEBI:78354) is a fluorinated steroid (CHEBI:50830)
fluorometholone acetate (CHEBI:78354) is a glucocorticoid (CHEBI:24261)
fluorometholone acetate (CHEBI:78354) is a steroid ester (CHEBI:47880)
IUPAC Names 
9-fluoro-11β-hydroxy-6α-methyl-3,20-dioxopregna-1,4-dien-17-yl acetate
(6α,11β)-9-fluoro-11-hydroxy-6-methyl-3,20-dioxopregna-1,4-dien-17-yl acetate
Synonyms  Source
Fluorometholone 17-acetateKEGG COMPOUND
9-Fluoro-11beta,17-dihydroxy-6alpha-methylpregna-1,4-diene-3,20-dione 17-acetateKEGG COMPOUND
6alpha-Methyl-9alpha-fluoro-17-acetoxy-21-deoxyprednisoloneKEGG COMPOUND
9-Fluoro-11beta,17-dihydroxy-6alpha-methylpregna-1,4-diene-3,20-dione 17-acetateChemIDplus
Brand Name  Source
FlarexKEGG DRUG
Manual XrefsDatabases
C14629KEGG COMPOUND
D04221KEGG DRUG
DB00324DrugBank
US5149693Patent
FluorometholoneWikipedia
WO9001933Patent
WO0025727Patent
4647DrugCentral
Registry NumbersSources
Reaxys:13572136Reaxys
CAS:3801-06-7KEGG COMPOUND
CAS:3801-06-7ChemIDplus
Citations