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CHEBI:5011 - fenpyroximate

ChEBI IDCHEBI:5011
ChEBI Namefenpyroximate
Stars
Last Modified9 March 2018
DownloadsMolfile
FormulaC24H27N3O4
Net Charge0
Average Mass421.497
Monoisotopic Mass421.20016
SMILESCc1nn(C)c(Oc2ccccc2)c1/C=N/OCc1ccc(C(=O)OC(C)(C)C)cc1
InChIInChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3/b25-15+
InChIKeyYYJNOYZRYGDPNH-MFKUBSTISA-N
Roles Classification
Biological Role:
ChEBI Ontology
Outgoing Relation(s)
fenpyroximate (CHEBI:5011) has parent hydride 1H-pyrazole (CHEBI:17241)
fenpyroximate (CHEBI:5011) has role mitochondrial NADH:ubiquinone reductase inhibitor (CHEBI:38498)
fenpyroximate (CHEBI:5011) is a tert-butyl ester (CHEBI:140402)
fenpyroximate (CHEBI:5011) is a pyrazole acaricide (CHEBI:38602)
IUPAC Name 
tert-butyl 4-[({[(1E)-(1,3-dimethyl-5-phenoxy-1H-pyrazol-4-yl)methylene]amino}oxy)methyl]benzoate
Synonyms  Source
FenpyroximateKEGG COMPOUND
t-butyl (E)-α-(1,3-dimethyl-5-phenoxypyrazol-4-ylmethyleneaminooxy)-p-toluateChemIDplus
Manual XrefsDatabases
C11098KEGG COMPOUND
309PPDB
Registry NumbersSources
Beilstein:8352707Beilstein
CAS:134098-61-6KEGG COMPOUND
CAS:134098-61-6ChemIDplus