EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:44104 - 2-(2-CARBOXY-ACETYLAMINO)-5-GUANIDINO-PENTANOIC ACID

Default Structure
ChEBI IDCHEBI:44104
ChEBI Name2-(2-CARBOXY-ACETYLAMINO)-5-GUANIDINO-PENTANOIC ACID
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC9H17N4O5
Net Charge+1
Average Mass261.258
Monoisotopic Mass261.11935
SMILES[H]OC(=O)C([H])([H])C(=O)N([H])[C@@]([H])(C(=O)O[H])C([H])([H])C([H])([H])C([H])([H])N([H])C(N([H])[H])=[N+]([H])[H]
InChIInChI=1S/C9H16N4O5/c10-9(11)12-3-1-2-5(8(17)18)13-6(14)4-7(15)16/h5H,1-4H2,(H,13,14)(H,15,16)(H,17,18)(H4,10,11,12)/p+1/t5-/m1/s1
InChIKeyOBXDDNPKMORRHB-RXMQYKEDSA-O
ChEBI Ontology
Outgoing Relation(s)
2-(2-CARBOXY-ACETYLAMINO)-5-GUANIDINO-PENTANOIC ACID (CHEBI:44104) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2-(2-CARBOXY-ACETYLAMINO)-5-GUANIDINO-PENTANOIC ACIDPDBeChem
amino({(4R)-4-carboxy-4-[(carboxyacetyl)amino]butyl}amino)methaniminiumPDBeChem
Manual XrefsDatabases
MGGPDBeChem