CHEBI:5134 - fluticasone

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ChEBI Name fluticasone
ChEBI ID CHEBI:5134
Definition A trifluorinated corticosteroid used in the form of its propionate ester for treatment of allergic rhinitis.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C22H27F3O4S
Net Charge 0
Average Mass 444.50800
Monoisotopic Mass 444.158
InChI InChI=1S/C22H27F3O4S/c1-11-6-13-14-8-16(24)15-7-12(26)4-5-19(15,2)21(14,25)17(27)9-20(13,3)22(11,29)18(28)30-10-23/h4-5,7,11,13-14,16-17,27,29H,6,8-10H2,1-3H3/t11-,13+,14+,16+,17+,19+,20+,21+,22+/m1/s1
InChIKey MGNNYOODZCAHBA-GQKYHHCASA-N
SMILES [H][C@@]12C[C@@H](C)[C@](O)(C(=O)SCF)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])C[C@H](F)C2=CC(=O)C=C[C@]12C
Roles Classification
Application(s): anti-asthmatic drug
A drug used to treat asthma.
anti-allergic agent
A drug used to treat allergic reactions.
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ChEBI Ontology
Outgoing fluticasone (CHEBI:5134) has parent hydride androstane (CHEBI:35509)
fluticasone (CHEBI:5134) has role anti-allergic agent (CHEBI:50857)
fluticasone (CHEBI:5134) has role anti-asthmatic drug (CHEBI:49167)
fluticasone (CHEBI:5134) is a 11β-hydroxy steroid (CHEBI:35346)
fluticasone (CHEBI:5134) is a 17α-hydroxy steroid (CHEBI:35342)
fluticasone (CHEBI:5134) is a 3-oxo-Δ4 steroid (CHEBI:47909)
fluticasone (CHEBI:5134) is a corticosteroid (CHEBI:50858)
fluticasone (CHEBI:5134) is a fluorinated steroid (CHEBI:50830)
fluticasone (CHEBI:5134) is a thioester (CHEBI:51277)
Incoming fluticasone furoate (CHEBI:74899) has functional parent fluticasone (CHEBI:5134)
fluticasone propionate (CHEBI:31441) has functional parent fluticasone (CHEBI:5134)
IUPAC Name
S-(fluoromethyl) (6α,11β,16α,17α)-6,9-difluoro-11,17-dihydroxy-16-methyl-3-oxoandrosta-1,4-diene-17-carbothioate
INNs Sources
fluticasona ChemIDplus
fluticasone WHO MedNet
fluticasone KEGG DRUG
fluticasonum ChemIDplus
Manual Xrefs Databases
C07815 KEGG COMPOUND
D07981 KEGG DRUG
Fluticasone Wikipedia
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Registry Numbers Types Sources
8173308 Reaxys Registry Number Reaxys
90566-53-3 CAS Registry Number KEGG COMPOUND
90566-53-3 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
22370858 PubMed citation Europe PMC
23276699 PubMed citation Europe PMC
23591272 PubMed citation Europe PMC
23796052 PubMed citation Europe PMC
Last Modified
06 September 2013