ketoconazole (CHEBI:47519)

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ChEBI Name	ketoconazole

ChEBI ID	CHEBI:47519

Definition	A racemate consisting of equimolar amounts of (2R,4S)- and (2S,4R)-ketoconazole.

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

Secondary ChEBI IDs	CHEBI:6126

Formula

C26H28Cl2N4O4

Net Charge

Average Mass

531.43048

Monoisotopic Mass

530.14876

Roles Classification
Biological Role(s):	antifungal drug Any antifungal agent used to prevent or treat fungal infections in humans or animals. (via imidazole antifungal drug ) (via conazole antifungal drug ) antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce. (via imidazole antifungal agent ) (via conazole antifungal agent ) ergosterol biosynthesis inhibitor Any compound that inhibits one or more steps in the pathway leading to the synthesis of ergosterol. (via conazole antifungal agent )

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

ChEBI Ontology
Outgoing	ketoconazole (CHEBI:47519) has part (2R,4S)-ketoconazole (CHEBI:48336) ketoconazole (CHEBI:47519) has part (2S,4R)-ketoconazole (CHEBI:47518) ketoconazole (CHEBI:47519) is a conazole antifungal drug (CHEBI:87071) ketoconazole (CHEBI:47519) is a imidazole antifungal drug (CHEBI:87069) ketoconazole (CHEBI:47519) is a racemate (CHEBI:60911)

IUPAC Name

rac-1-acetyl-4-(4-{[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazine

Synonyms	Sources
(±)-cis-1-acetyl-4-(p-((2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazine	ChemIDplus
cis-1-acetyl-4-(4-((2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazine	ChemIDplus

Last Modified

22 February 2017