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CHEBI:168916 - (3-Nitroamino)alanine

ChEBI IDCHEBI:168916
ChEBI Name(3-Nitroamino)alanine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC3H7N3O4
Net Charge0
Average Mass149.106
Monoisotopic Mass149.04366
SMILESNC(CN[N+](=O)[O-])C(=O)O
InChIInChI=1S/C3H7N3O4/c4-2(3(7)8)1-5-6(9)10/h2,5H,1,4H2,(H,7,8)
InChIKeyQMXHUFVYJLFLRY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
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).
ChEBI Ontology
Outgoing Relation(s)
(3-Nitroamino)alanine (CHEBI:168916) is a α-amino acid (CHEBI:33704)
IUPAC Name 
2-amino-3-nitramidopropanoic acid
Manual XrefsDatabases
32979054ChemSpider
HMDB0029398HMDB