pyraclostrobin (CHEBI:78780)

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ChEBI Name	pyraclostrobin

ChEBI ID	CHEBI:78780

Definition	A carbamate ester that is the methyl ester of [2-({[1-(4-chlorophenyl)-1H-pyrazol-3-yl]oxy}methyl)phenyl]methoxycarbamic acid. A fungicide used to control major plant pathogens including Septoria tritici, Puccinia spp. and Pyrenophora teres.

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

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Formula

C19H18ClN3O4

Net Charge

Average Mass

387.81700

Monoisotopic Mass

387.09858

InChI

InChI=1S/C19H18ClN3O4/c1-25-19(24)23(26-2)17-6-4-3-5-14(17)13-27-18-11-12-22(21-18)16-9-7-15(20)8-10-16/h3-12H,13H2,1-2H3

InChIKey

HZRSNVGNWUDEFX-UHFFFAOYSA-N

SMILES

CON(C(=O)OC)c1ccccc1COc1ccn(n1)-c1ccc(Cl)cc1

Roles Classification
Chemical Role(s):	environmental contaminant Any minor or unwanted substance introduced into the environment that can have undesired effects.

Biological Role(s):	mitochondrial cytochrome-bc1 complex inhibitor xenobiotic A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means. antifungal agrochemical Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties. fungicide A substance used to destroy fungal pests. (via carbanilate fungicide ) (via carbamate fungicide ) antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce. (via methoxycarbanilate strobilurin antifungal agent ) (via strobilurin antifungal agent ) (via antibiotic 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 carbanilate fungicide ) (via carbamate fungicide )

ChEBI Ontology
Outgoing	pyraclostrobin (CHEBI:78780) has role antifungal agrochemical (CHEBI:86328) pyraclostrobin (CHEBI:78780) has role environmental contaminant (CHEBI:78298) pyraclostrobin (CHEBI:78780) has role mitochondrial cytochrome-bc₁ complex inhibitor (CHEBI:38499) pyraclostrobin (CHEBI:78780) has role xenobiotic (CHEBI:35703) pyraclostrobin (CHEBI:78780) is a aromatic ether (CHEBI:35618) pyraclostrobin (CHEBI:78780) is a carbamate ester (CHEBI:23003) pyraclostrobin (CHEBI:78780) is a carbanilate fungicide (CHEBI:87066) pyraclostrobin (CHEBI:78780) is a methoxycarbanilate strobilurin antifungal agent (CHEBI:86485) pyraclostrobin (CHEBI:78780) is a monochlorobenzenes (CHEBI:83403) pyraclostrobin (CHEBI:78780) is a pyrazoles (CHEBI:26410)

IUPAC Name

methyl [2-({[1-(4-chlorophenyl)-1H-pyrazol-3-yl]oxy}methyl)phenyl]methoxycarbamate

Synonym	Source
Pyraclostrobine	NIST Chemistry WebBook

Last Modified

22 July 2015