CHEBI:81696 - asulam

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ChEBI Name asulam
ChEBI ID CHEBI:81696
Definition A carbamate ester that is methyl carbamate substituted by a (4-aminophenyl)sulfonyl group at the nitrogen atom. A dihydropteroate synthase inhibitor, it is used (normally as the corresponding sodium salt, asulam-sodium) as a herbicide, mainly for killing bracken.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C8H10N2O4S
Net Charge 0
Average Mass 230.24100
Monoisotopic Mass 230.036
InChI InChI=1S/C8H10N2O4S/c1-14-8(11)10-15(12,13)7-4-2-6(9)3-5-7/h2-5H,9H2,1H3,(H,10,11)
InChIKey VGPYEHKOIGNJKV-UHFFFAOYSA-N
SMILES COC(=O)NS(=O)(=O)c1ccc(N)cc1
Roles Classification
Chemical Role(s): environmental contaminant
Any minor or unwanted substance introduced into the environment that can have undesired effects.
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): EC 2.5.1.15 (dihydropteroate synthase) inhibitor
An EC 2.5.1.* (non-methyl-alkyl or aryl transferase) inhibitor that interferes with the action of dihydropteroate synthase (EC 2.5.1.15), an enzyme that catalyzes the formation of dihydropteroate from p-aminobenzoic acid and dihydropteridine-hydroxymethyl-pyrophosphate.
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.
Application(s): agrochemical
An agrochemical is a substance that is used in agriculture or horticulture.
herbicide
A substance used to destroy plant pests.
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ChEBI Ontology
Outgoing asulam (CHEBI:81696) has role agrochemical (CHEBI:33286)
asulam (CHEBI:81696) has role EC 2.5.1.15 (dihydropteroate synthase) inhibitor (CHEBI:50502)
asulam (CHEBI:81696) has role environmental contaminant (CHEBI:78298)
asulam (CHEBI:81696) has role herbicide (CHEBI:24527)
asulam (CHEBI:81696) has role xenobiotic (CHEBI:35703)
asulam (CHEBI:81696) is a carbamate ester (CHEBI:23003)
asulam (CHEBI:81696) is a primary amino compound (CHEBI:50994)
asulam (CHEBI:81696) is a substituted aniline (CHEBI:48975)
asulam (CHEBI:81696) is a sulfonamide (CHEBI:35358)
asulam (CHEBI:81696) is conjugate acid of asulam(1−) (CHEBI:142669)
Incoming asulam(1−) (CHEBI:142669) is conjugate base of asulam (CHEBI:81696)
IUPAC Name
methyl [(4-aminophenyl)sulfonyl]carbamate
Synonyms Sources
4-Amino-benzolsulfonyl-methylcarbamat ChemIDplus
asulame ChemIDplus
methyl N-(4-aminobenzenesulfonyl)carbamate ChemIDplus
methyl sulfanilylcarbamate ChemIDplus
N1-methoxycarbonylsulfanilamide ChemIDplus
Manual Xrefs Databases
1551 PPDB
asulam Alan Wood's Pesticides
Asulam Wikipedia
BE622214 Patent
C18350 KEGG COMPOUND
CN101492401 Patent
CN101704771 Patent
View more database links
Registry Numbers Types Sources
2697523 Reaxys Registry Number Reaxys
3337-71-1 CAS Registry Number KEGG COMPOUND
3337-71-1 CAS Registry Number NIST Chemistry WebBook
3337-71-1 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
1452156 PubMed citation Europe PMC
18965512 PubMed citation Europe PMC
29673416 PubMed citation Europe PMC
6711013 PubMed citation Europe PMC
IND44109762 Agricola citation Europe PMC
Last Modified
29 November 2018
General Comment
2014-10-29 Stravs M, Schymanski E, Singer H, Department of Environmental Chemistry, Eawag