CHEBI:38470 - butoxycarboxim

ChEBI IDCHEBI:38470
ChEBI Namebutoxycarboxim
Stars
Last Modified3 August 2014
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC7H14N2O4S
Net Charge0
Average Mass222.266
Monoisotopic Mass222.06743
SMILESCNC(=O)ON=C(C)C(C)S(C)(=O)=O
InChIInChI=1S/C7H14N2O4S/c1-5(6(2)14(4,11)12)9-13-7(10)8-3/h6H,1-4H3,(H,8,10)
InChIKeyCTJBHIROCMPUKL-UHFFFAOYSA-N
Roles Classification
Biological Roles:
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.
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.
Applications:
agrochemical  An agrochemical is a substance that is used in agriculture or horticulture.
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.
ChEBI Ontology
Outgoing Relation(s)
butoxycarboxim (CHEBI:38470) has role agrochemical (CHEBI:33286)
butoxycarboxim (CHEBI:38470) has role carbamate insecticide (CHEBI:38461)
butoxycarboxim (CHEBI:38470) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
butoxycarboxim (CHEBI:38470) is a carbamate ester (CHEBI:23003)
IUPAC Name 
N-(methylcarbamoyloxy)-3-(methanesulfonyl)butan-2-imine
Synonyms  Source
3-(Methylsulfonyl)-2-butanone O-(methylcarbamoyl)oximeChemIDplus
3-(Methylsulfonyl)-2-butanone O-((methylamino)carbonyl)oximeChemIDplus
ButoxycarboximeChEBI
3-Mesylbutanone O-methylcarbamoyloximeChemIDplus
Manual XrefsDatabases
C18646KEGG COMPOUND
103PPDB
Registry NumbersSources
CAS:34681-23-7ChemIDplus
CAS:34681-23-7KEGG COMPOUND