CHEBI:180595 - N-Nitroso-N-methyl-3-aminopropionic acid

ChEBI IDCHEBI:180595
ChEBI NameN-Nitroso-N-methyl-3-aminopropionic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC4H8N2O3
Net Charge0
Average Mass132.119
Monoisotopic Mass132.05349
SMILESCN(CCC(=O)O)N=O
InChIInChI=1S/C4H8N2O3/c1-6(5-9)3-2-4(7)8/h2-3H2,1H3,(H,7,8)
InChIKeyJZVIGHIXBBLOEB-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) pancreas (BTO:0000988) MetaboLights (MTBLS1925) Strain: PANC-1 cell [BCGO:0000122]
ChEBI Ontology
Outgoing Relation(s)
N-Nitroso-N-methyl-3-aminopropionic acid (CHEBI:180595) is a nitrosamine (CHEBI:35803)
IUPAC Name 
3-[methyl(nitroso)amino]propanoic acid
Manual XrefsDatabases
133541ChemSpider
Registry NumbersSources
CAS:10478-42-9ChemIDplus