tilorone (CHEBI:147347)

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ChEBI Name	tilorone

ChEBI ID	CHEBI:147347

Definition	A member of the class of fluoren-9-ones that is 9H-fluoren-9-one which is substituted by a 2-(diethylamino)ethoxy group at positions 2 and 7. It is an interferon inducer and a selective α7 nicotinic acetylcholine receptor (α7 nAChR) agonist. Its hydrochloride salt is used as an antiviral drug.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:109553

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Formula

C25H34N2O3

Net Charge

Average Mass

410.558

Monoisotopic Mass

410.25694

InChI

InChI=1S/C25H34N2O3/c1-5-26(6-2)13-15-29-19-9-11-21-22-12-10-20(30-16-14-27(7-3)8-4)18-24(22)25(28)23(21)17-19/h9-12,17-18H,5-8,13-16H2,1-4H3

InChIKey

MPMFCABZENCRHV-UHFFFAOYSA-N

SMILES

C1=2C=3C(C(C1=CC(=CC2)OCCN(CC)CC)=O)=CC(=CC3)OCCN(CC)CC

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Biological Role(s):	antiviral agent A substance that destroys or inhibits replication of viruses. nicotinic acetylcholine receptor agonist An agonist that selectively binds to and activates a nicotinic acetylcholine receptor. xenobiotic A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means. (via fluorenes )

Application(s):	interferon inducer An agent that promotes the production and release of interferons. antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. anti-inflammatory agent Any compound that has anti-inflammatory effects. nicotinic acetylcholine receptor agonist An agonist that selectively binds to and activates a nicotinic acetylcholine receptor.

ChEBI Ontology
Outgoing	tilorone (CHEBI:147347) has role anti-inflammatory agent (CHEBI:67079) tilorone (CHEBI:147347) has role antineoplastic agent (CHEBI:35610) tilorone (CHEBI:147347) has role antiviral agent (CHEBI:22587) tilorone (CHEBI:147347) has role interferon inducer (CHEBI:36710) tilorone (CHEBI:147347) has role nicotinic acetylcholine receptor agonist (CHEBI:47958) tilorone (CHEBI:147347) is a aromatic ether (CHEBI:35618) tilorone (CHEBI:147347) is a diether (CHEBI:46786) tilorone (CHEBI:147347) is a fluoren-9-ones (CHEBI:24057) tilorone (CHEBI:147347) is a tertiary amino compound (CHEBI:50996) tilorone (CHEBI:147347) is conjugate base of tilorone(2+) (CHEBI:147355)

Incoming	tilorone(2+) (CHEBI:147355) is conjugate acid of tilorone (CHEBI:147347)

IUPAC Name

2,7-bis[2-(diethylamino)ethoxy]-9H-fluoren-9-one

Synonym	Source
2,7-bis[2-(diethylamino)ethoxy]-9-fluorenone	ChEBI

Registry Number	Type	Source
27591-97-5	CAS Registry Number	ChemIDplus

Last Modified

01 April 2020