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> Main
CHEBI:5134 - fluticasone
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ChEBI Ontology
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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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Read full article at Wikipedia
Formula
C22H27F3O4S
Net Charge
0
Average Mass
444.50800
Monoisotopic Mass
444.15822
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.
View more via ChEBI Ontology
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-Δ
4
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
View more database links
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
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