CHEBI:34556 - bendiocarb

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ChEBI Name bendiocarb
ChEBI ID CHEBI:34556
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C11H13NO4
Net Charge 0
Average Mass 223.22526
Monoisotopic Mass 223.084
InChI InChI=1S/C11H13NO4/c1-11(2)15-8-6-4-5-7(9(8)16-11)14-10(13)12-3/h4-6H,1-3H3,(H,12,13)
InChIKey XEGGRYVFLWGFHI-UHFFFAOYSA-N
SMILES CNC(=O)Oc1cccc2OC(C)(C)Oc12
Roles Classification
Biological Role(s): 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.
Application(s): 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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing bendiocarb (CHEBI:34556) has functional parent methylcarbamic acid (CHEBI:45379)
bendiocarb (CHEBI:34556) has role agrochemical (CHEBI:33286)
bendiocarb (CHEBI:34556) has role carbamate insecticide (CHEBI:38461)
bendiocarb (CHEBI:34556) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
bendiocarb (CHEBI:34556) is a benzodioxoles (CHEBI:38298)
bendiocarb (CHEBI:34556) is a carbamate ester (CHEBI:23003)
IUPAC Name
2,2-dimethyl-1,3-benzodioxol-4-yl methylcarbamate
Synonyms Sources
2,2-Dimethyl-1,3-benzodioxol-4-ol methylcarbamate KEGG COMPOUND
2,2-dimethyl-4-(methylcarbamoyloxy)-1,3-benzodioxole ChEBI
2,3-Isopropylidenedioxyphenyl methylcarbamate NIST Chemistry WebBook
Bendiocarb KEGG COMPOUND
Database Link Database
C14433 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
1315404 Beilstein Registry Number Beilstein
22781-23-3 CAS Registry Number ChemIDplus
Last Modified
18 November 2013