azaconazole (CHEBI:81898)

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ChEBI Name	azaconazole

ChEBI ID	CHEBI:81898

Definition	A member of the class of dioxolanes that is 1,3-dioxolane substituted at position 2 by 2,4-dichlorophenyl and 1,2,4-triazol-1-ylmethyl groups. A fungicide used mainly in ornamental crops to control canker and other diseases. Azaconazole is moderately toxic to mammals but is not expected to bioaccumulate. It is moderately toxic to birds, fish and aquatic invertebrates.

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

Supplier Information

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Formula

C12H11Cl2N3O2

Net Charge

Average Mass

300.14100

Monoisotopic Mass

299.02283

InChI

InChI=1S/C12H11Cl2N3O2/c13-9-1-2-10(11(14)5-9)12(18-3-4-19-12)6-17-8-15-7-16-17/h1-2,5,7-8H,3-4,6H2

InChIKey

AKNQMEBLVAMSNZ-UHFFFAOYSA-N

SMILES

Clc1ccc(c(Cl)c1)C1(Cn2cncn2)OCCO1

Roles Classification
Biological Role(s):	antifungal agrochemical Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties. EC 1.14.13.70 (sterol 14alpha-demethylase) 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 EC 1.14.13.70 (sterol 14alpha-demethylase). fungicide A substance used to destroy fungal pests. (via triazole fungicide ) (via conazole fungicide ) antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce. (via triazole 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 agrochemical Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties. fungicide A substance used to destroy fungal pests. (via triazole fungicide ) (via conazole fungicide )

ChEBI Ontology
Outgoing	azaconazole (CHEBI:81898) has role antifungal agrochemical (CHEBI:86328) azaconazole (CHEBI:81898) has role EC 1.14.13.70 (sterol 14α-demethylase) inhibitor (CHEBI:77884) azaconazole (CHEBI:81898) is a conazole fungicide (CHEBI:87067) azaconazole (CHEBI:81898) is a cyclic ketal (CHEBI:59779) azaconazole (CHEBI:81898) is a dichlorobenzene (CHEBI:23697) azaconazole (CHEBI:81898) is a dioxolane (CHEBI:39430) azaconazole (CHEBI:81898) is a triazole fungicide (CHEBI:87100) azaconazole (CHEBI:81898) is a triazoles (CHEBI:35727)

Synonym	Source
R-28644	NIST Chemistry WebBook

Citation	Type	Source
3969677	PubMed citation	Europe PMC

Last Modified

23 July 2015