CHEBI:38465 - butocarboxim

ChEBI IDCHEBI:38465
ChEBI Namebutocarboxim
Stars
Last Modified3 August 2014
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC7H14N2O2S
Net Charge0
Average Mass190.268
Monoisotopic Mass190.07760
SMILESCNC(=O)O/N=C(/C)C(C)SC
InChIInChI=1S/C7H14N2O2S/c1-5(6(2)12-4)9-11-7(10)8-3/h6H,1-4H3,(H,8,10)/b9-5-
InChIKeySFNPDDSJBGRXLW-UITAMQMPSA-N
Roles Classification
Biological Roles:
carbamate insecticide  Derivatives of carbamic acid with insecticidal properties of general formula ROC(=O)NR1R2, where ROH is an alcohol, oxime, or phenol and R1 is hydrogen or methyl. Like organophosphate insecticides, they are cholinesterase inhibitors, but carbamate insecticides differ in action from the organophosphates in that the inhibitory effect on cholinesterase is generally brief.
EC 3.1.1.7 (acetylcholinesterase) inhibitor  An EC 3.1.1.* (carboxylic ester hydrolase) inhibitor that interferes with the action of enzyme acetylcholinesterase (EC 3.1.1.7), which helps breaking down of acetylcholine into choline and acetic acid.
Applications:
acaricide  A substance used to destroy pests of the subclass Acari (mites and ticks).
carbamate insecticide  Derivatives of carbamic acid with insecticidal properties of general formula ROC(=O)NR1R2, where ROH is an alcohol, oxime, or phenol and R1 is hydrogen or methyl. Like organophosphate insecticides, they are cholinesterase inhibitors, but carbamate insecticides differ in action from the organophosphates in that the inhibitory effect on cholinesterase is generally brief.
agrochemical  An agrochemical is a substance that is used in agriculture or horticulture.
ChEBI Ontology
Outgoing Relation(s)
butocarboxim (CHEBI:38465) has functional parent 3-(methylsulfanyl)butan-2-one oxime (CHEBI:38469)
butocarboxim (CHEBI:38465) has role acaricide (CHEBI:22153)
butocarboxim (CHEBI:38465) has role agrochemical (CHEBI:33286)
butocarboxim (CHEBI:38465) has role carbamate insecticide (CHEBI:38461)
butocarboxim (CHEBI:38465) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
butocarboxim (CHEBI:38465) is a carbamate ester (CHEBI:23003)
IUPAC Name 
N-(methylcarbamoyloxy)-3-(methylsulfanyl)butan-2-imine
Synonyms  Source
(2E)-2-(([(Methylamino)carbonyl]oxy)imino)-3-(methylsulfanyl)butaneNIST Chemistry WebBook
3-(Methylthio)-2-butanone O-((methylamino)carbonyl)oximeChemIDplus
3-(Methylthio)-2-butanone O-(methylcarbamoyl)oximeChemIDplus
AfilineChemIDplus
ButocarboximeChemIDplus
Manual XrefsDatabases
C18645KEGG COMPOUND
Registry NumbersSources
Beilstein:2087348Beilstein
CAS:34681-10-2ChemIDplus
CAS:34681-10-2KEGG COMPOUND