butenafine hydrochloride (CHEBI:31325)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	butenafine hydrochloride

ChEBI ID	CHEBI:31325

Definition	The hydrochloride salt of butenafine. An inhibitor of squalene epoxidase, an enzyme responsible for the creation of sterols needed in fungal cell membranes, it is used for treatment of dermatological fungal infections.

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

Supplier Information

Download	Molfile XML SDF

more structures >>

Formula

C23H28ClN

Net Charge

Average Mass

353.92800

Monoisotopic Mass

353.19103

InChI

InChI=1S/C23H27N.ClH/c1-23(2,3)21-14-12-18(13-15-21)16-24(4)17-20-10-7-9-19-8-5-6-11-22(19)20;/h5-15H,16-17H2,1-4H3;1H

InChIKey

LJBSAUIFGPSHCN-UHFFFAOYSA-N

SMILES

Cl.CN(Cc1ccc(cc1)C(C)(C)C)Cc1cccc2ccccc12

Roles Classification
Biological Role(s):	antifungal drug Any antifungal agent used to prevent or treat fungal infections in humans or animals. EC 1.14.13.132 (squalene monooxygenase) inhibitor An EC 1.14.13.* (oxidoreductase acting on paired donors, incorporating 1 atom of oxygen, with NADH or NADPH as one donor) inhibitor that interferes with the action of squalene monooxygenase (EC 1.14.13.132).

Application(s):	antifungal drug Any antifungal agent used to prevent or treat fungal infections in humans or animals.

ChEBI Ontology
Outgoing	butenafine hydrochloride (CHEBI:31325) has part butenafine (CHEBI:3238) butenafine hydrochloride (CHEBI:31325) has role antifungal drug (CHEBI:86327) butenafine hydrochloride (CHEBI:31325) has role EC 1.14.13.132 (squalene monooxygenase) inhibitor (CHEBI:59285) butenafine hydrochloride (CHEBI:31325) is a ammonium salt (CHEBI:47704) butenafine hydrochloride (CHEBI:31325) is a hydrochloride (CHEBI:36807)

IUPAC Name

1-(4-tert-butylphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)methanamine hydrochloride

Synonyms	Sources
(4-tert-butylphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)methanaminium chloride	IUPAC
4-tert-butylbenzyl(methyl)(1-naphthalenemethyl)amine hydrochloride	ChEBI
butenafine HCl	ChemIDplus
Butenafine hydrochloride	KEGG COMPOUND
N-(p-tert-butylbenzyl)-N-methyl-1-naphthalenemethylamine hydrochloride	ChemIDplus

Last Modified

24 July 2015