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.

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

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

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.

anti-asthmatic drug A drug used to treat asthma.

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

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