fluticasone propionate (CHEBI:31441)

CHEBI:31441 - fluticasone propionate

ChEBI ID	CHEBI:31441
ChEBI Name	fluticasone propionate
Stars
Definition	A trifluorinated corticosteroid that consists of 6α,9-difluoro-11β,17α-dihydroxy-17β-{[(fluoromethyl)sulfanyl]carbonyl}-16-methyl-3-oxoandrosta-1,4-diene bearing a propionyl substituent at position 17; has anti-inflammatory, anti-asthmatic and anti-allergic activity.
Secondary ChEBI ID	CHEBI:63600
Last Modified	15 August 2019
Downloads	Molfile

Formula	C25H31F3O5S
Net Charge	0
Average Mass	500.579
Monoisotopic Mass	500.18443
SMILES	[H][C@@]12C[C@@H](C)[C@](OC(=O)CC)(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@@]21C
InChI	InChI=1S/C25H31F3O5S/c1-5-20(31)33-25(21(32)34-12-26)13(2)8-15-16-10-18(27)17-9-14(29)6-7-22(17,3)24(16,28)19(30)11-23(15,25)4/h6-7,9,13,15-16,18-19,30H,5,8,10-12H2,1-4H3/t13-,15+,16+,18+,19+,22+,23+,24+,25+/m1/s1
InChIKey	WMWTYOKRWGGJOA-CENSZEJFSA-N

Wikipedia

Roles Classification

adrenergic agent Any agent that acts on an adrenergic receptor or affects the life cycle of an adrenergic transmitter.

anti-allergic agent A drug used to treat allergic reactions.

bronchodilator agent An agent that causes an increase in the expansion of a bronchus or bronchial tubes.

adrenergic agent Any agent that acts on an adrenergic receptor or affects the life cycle of an adrenergic transmitter.

anti-inflammatory drug A substance that reduces or suppresses inflammation.

anti-asthmatic drug A drug used to treat asthma.

dermatologic drug A drug used to treat or prevent skin disorders or for the routine care of skin.

ChEBI Ontology

Outgoing Relation(s)
	fluticasone propionate (CHEBI:31441) has functional parent fluticasone (CHEBI:5134)
	fluticasone propionate (CHEBI:31441) has parent hydride androstane (CHEBI:35509)
	fluticasone propionate (CHEBI:31441) has role adrenergic agent (CHEBI:37962)
	fluticasone propionate (CHEBI:31441) has role anti-allergic agent (CHEBI:50857)
	fluticasone propionate (CHEBI:31441) has role anti-asthmatic drug (CHEBI:49167)
	fluticasone propionate (CHEBI:31441) has role anti-inflammatory drug (CHEBI:35472)
	fluticasone propionate (CHEBI:31441) has role bronchodilator agent (CHEBI:35523)
	fluticasone propionate (CHEBI:31441) has role dermatologic drug (CHEBI:50177)
	fluticasone propionate (CHEBI:31441) is a 11β-hydroxy steroid (CHEBI:35346)
	fluticasone propionate (CHEBI:31441) is a 3-oxo-Δ¹,Δ⁴-steroid (CHEBI:77166)
	fluticasone propionate (CHEBI:31441) is a corticosteroid (CHEBI:50858)
	fluticasone propionate (CHEBI:31441) is a fluorinated steroid (CHEBI:50830)
	fluticasone propionate (CHEBI:31441) is a propanoate ester (CHEBI:36243)
	fluticasone propionate (CHEBI:31441) is a steroid ester (CHEBI:47880)
	fluticasone propionate (CHEBI:31441) is a thioester (CHEBI:51277)

IUPAC Name
6α,9-difluoro-17β-{[(fluoromethyl)sulfanyl]carbonyl}-11β-hydroxy-16-methyl-3-oxoandrosta-1,4-dien-17α-yl propanoate

Synonym	Source
Fluticasone propionate	KEGG COMPOUND

Brand Name	Source
Cutivate	DrugBank

Registry Numbers	Sources
Reaxys:6944704	Reaxys
CAS:80474-14-2	ChemIDplus