CHEBI:182149 - 5-(Amidinoamino)-2-[(carboxyethyl)amino]pentanoic acid

ChEBI IDCHEBI:182149
ChEBI Name5-(Amidinoamino)-2-[(carboxyethyl)amino]pentanoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H18N4O4
Net Charge0
Average Mass246.267
Monoisotopic Mass246.13281
SMILESCC(NC(CCCN=C(N)N)C(=O)O)C(=O)O
InChIInChI=1S/C9H18N4O4/c1-5(7(14)15)13-6(8(16)17)3-2-4-12-9(10)11/h5-6,13H,2-4H2,1H3,(H,14,15)(H,16,17)(H4,10,11,12)
InChIKeyIMXSCCDUAFEIOE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-(Amidinoamino)-2-[(carboxyethyl)amino]pentanoic acid (CHEBI:182149) is a alanine derivative (CHEBI:22278)
IUPAC Name 
2-(1-carboxyethylamino)-5-(diaminomethylideneamino)pentanoic acid
Manual XrefsDatabases
C04137KEGG COMPOUND
CPD-309MetaCyc
414ChemSpider