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CHEBI:45379 - methylcarbamic acid

ChEBI IDCHEBI:45379
ChEBI Namemethylcarbamic acid
Stars
DefinitionAn amino acid consisting of carbamic acid having an N-methyl substituent.
Secondary ChEBI IDsCHEBI:38464, CHEBI:45374
Last Modified7 October 2022
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC2H5NO2
Net Charge0
Average Mass75.067
Monoisotopic Mass75.03203
SMILESCNC(=O)O
InChIInChI=1S/C2H5NO2/c1-3-2(4)5/h3H,1H3,(H,4,5)
InChIKeyUFEJKYYYVXYMMS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aminobacter sp. MDW-2 (ncbitaxon:2666139) - PubMed (28083911)
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
bacterial xenobiotic metabolite  Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
ChEBI Ontology
Outgoing Relation(s)
methylcarbamic acid (CHEBI:45379) has functional parent carbamic acid (CHEBI:28616)
methylcarbamic acid (CHEBI:45379) has role bacterial xenobiotic metabolite (CHEBI:76976)
methylcarbamic acid (CHEBI:45379) is a amino acid (CHEBI:33709)
methylcarbamic acid (CHEBI:45379) is conjugate acid of methylcarbamate (CHEBI:193111)
Incoming Relation(s)
aminocarb (CHEBI:2653) has functional parent methylcarbamic acid (CHEBI:45379)
bendiocarb (CHEBI:34556) has functional parent methylcarbamic acid (CHEBI:45379)
carbaryl (CHEBI:3390) has functional parent methylcarbamic acid (CHEBI:45379)
ethiofencarb (CHEBI:38483) has functional parent methylcarbamic acid (CHEBI:45379)
fenobucarb (CHEBI:34304) has functional parent methylcarbamic acid (CHEBI:45379)
formetanate (CHEBI:38491) has functional parent methylcarbamic acid (CHEBI:45379)
isoprocarb (CHEBI:38505) has functional parent methylcarbamic acid (CHEBI:45379)
methiocarb (CHEBI:38508) has functional parent methylcarbamic acid (CHEBI:45379)
methomyl (CHEBI:6835) has functional parent methylcarbamic acid (CHEBI:45379)
metolcarb (CHEBI:38537) has functional parent methylcarbamic acid (CHEBI:45379)
oxamyl (CHEBI:38539) has functional parent methylcarbamic acid (CHEBI:45379)
propoxur (CHEBI:34938) has functional parent methylcarbamic acid (CHEBI:45379)
thiofanox (CHEBI:38549) has functional parent methylcarbamic acid (CHEBI:45379)
XMC (CHEBI:38571) has functional parent methylcarbamic acid (CHEBI:45379)
xylylcarb (CHEBI:35048) has functional parent methylcarbamic acid (CHEBI:45379)
methylcarbamate (CHEBI:193111) is conjugate base of methylcarbamic acid (CHEBI:45379)
IUPAC Name 
methylcarbamic acid
Synonyms  Source
MethylcarbamidsäureChEBI
N-methylcarbamic acidChEBI
Manual XrefsDatabases
RGIPDBeChem
Registry NumbersSources
Beilstein:1738994Beilstein
Reaxys:1738994Reaxys
CAS:6414-57-9ChemIDplus
Citations