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CHEBI:180947 - DL-Canavanine

ChEBI IDCHEBI:180947
ChEBI NameDL-Canavanine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC5H12N4O3
Net Charge0
Average Mass176.176
Monoisotopic Mass176.09094
SMILESNC(N)=NOCCC(N)C(=O)O
InChIInChI=1S/C5H12N4O3/c6-3(4(10)11)1-2-12-9-5(7)8/h3H,1-2,6H2,(H,10,11)(H4,7,8,9)
InChIKeyFSBIGDSBMBYOPN-UHFFFAOYSA-N
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)
DL-Canavanine (CHEBI:180947) is a α-amino acid (CHEBI:33704)
IUPAC Name 
2-amino-4-(diaminomethylideneamino)oxybutanoic acid
Manual XrefsDatabases
269ChemSpider
Registry NumbersSources
CAS:13269-28-8ChemIDplus