terbinafine hydrochloride (CHEBI:77614)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	terbinafine hydrochloride

ChEBI ID	CHEBI:77614

Definition	A hydrochloride obtained by reaction of terbinafine with one molar equivalent of hydrogen chloride.

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

Supplier Information

Download	Molfile XML SDF

more structures >>

Wikipedia	License

Read full article at Wikipedia

Formula

C21H26ClN

Net Charge

Average Mass

327.89100

Monoisotopic Mass

327.17538

InChI

InChI=1S/C21H25N.ClH/c1-21(2,3)15-8-5-9-16-22(4)17-19-13-10-12-18-11-6-7-14-20(18)19;/h5-7,9-14H,16-17H2,1-4H3;1H/b9-5+;

InChIKey

BWMISRWJRUSYEX-SZKNIZGXSA-N

SMILES

Cl.CN(C\C=C\C#CC(C)(C)C)Cc1cccc2ccccc12

Roles Classification
Biological Role(s):	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). P450 inhibitor An enzyme inhibitor that interferes with the activity of cytochrome P450 involved in catalysis of organic substances. antifungal drug Any antifungal agent used to prevent or treat fungal infections in humans or animals. (via allylamine antifungal drug )

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

ChEBI Ontology
Outgoing	terbinafine hydrochloride (CHEBI:77614) has part terbinafine(1+) (CHEBI:77615) terbinafine hydrochloride (CHEBI:77614) has role EC 1.14.13.132 (squalene monooxygenase) inhibitor (CHEBI:59285) terbinafine hydrochloride (CHEBI:77614) has role P450 inhibitor (CHEBI:50183) terbinafine hydrochloride (CHEBI:77614) is a allylamine antifungal drug (CHEBI:87127) terbinafine hydrochloride (CHEBI:77614) is a hydrochloride (CHEBI:36807)

IUPAC Names

(2E)-N,6,6-trimethyl-N-(1-naphthylmethyl)hept-2-en-4-yn-1-amine hydrochloride

(2E)-N,6,6-trimethyl-N-(1-naphthylmethyl)hept-2-en-4-yn-1-aminium chloride

Synonyms	Sources
(E)-N-(6,6-Dimethyl-2-hepten-4-ynyl)-N-methyl-1-naphthalenemethylamine hydrochloride	ChemIDplus
Terbinafine HCl	ChemIDplus
terbinafine monohydrochloride	ChEBI

Brand Name	Source
Lamisil	KEGG DRUG

Last Modified

24 July 2015