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CHEBI:81898 - azaconazole

ChEBI IDCHEBI:81898
ChEBI Nameazaconazole
Stars
DefinitionA 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.
Last Modified23 July 2015
DownloadsMolfile
FormulaC12H11Cl2N3O2
Net Charge0
Average Mass300.145
Monoisotopic Mass299.02283
SMILESClc1ccc(C2(Cn3cncn3)OCCO2)c(Cl)c1
InChIInChI=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
InChIKeyAKNQMEBLVAMSNZ-UHFFFAOYSA-N
Roles Classification
Biological Roles:
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 14α-demethylase).
antifungal agrochemical  Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties.
fungicide  A substance used to destroy fungal pests.
ergosterol biosynthesis inhibitor  Any compound that inhibits one or more steps in the pathway leading to the synthesis of ergosterol.
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
fungicide  A substance used to destroy fungal pests.
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
ergosterol biosynthesis inhibitor  Any compound that inhibits one or more steps in the pathway leading to the synthesis of ergosterol.
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
Applications:
antifungal agrochemical  Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties.
fungicide  A substance used to destroy fungal pests.
fungicide  A substance used to destroy fungal pests.
ChEBI Ontology
Outgoing Relation(s)
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)
INNs  Source
azaconazoleKEGG DRUG
azaconazoleChemIDplus
azaconazolChemIDplus
azaconazolumChemIDplus
Synonym  Source
R-28644NIST Chemistry WebBook
Manual XrefsDatabases
C18701KEGG COMPOUND
D03023KEGG DRUG
azaconazoleAlan Wood's Pesticides
45PPDB
Registry NumbersSources
Reaxys:822252Reaxys
CAS:60207-31-0KEGG COMPOUND
CAS:60207-31-0ChemIDplus
CAS:60207-31-0NIST Chemistry WebBook
Citations