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CHEBI:165185 - N2,N6-bis(2,3-Dihydroxybenzoyl)-L-lysine

ChEBI IDCHEBI:165185
ChEBI NameN2,N6-bis(2,3-Dihydroxybenzoyl)-L-lysine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H22N2O8
Net Charge0
Average Mass418.402
Monoisotopic Mass418.13762
SMILESO=C(NCCCC[C@H](NC(=O)c1cccc(O)c1O)C(=O)O)c1cccc(O)c1O
InChIInChI=1S/C20H22N2O8/c23-14-8-3-5-11(16(14)25)18(27)21-10-2-1-7-13(20(29)30)22-19(28)12-6-4-9-15(24)17(12)26/h3-6,8-9,13,23-26H,1-2,7,10H2,(H,21,27)(H,22,28)(H,29,30)/t13-/m0/s1
InChIKeyKQPFLOCEYZIIRD-ZDUSSCGKSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
N2,N6-bis(2,3-Dihydroxybenzoyl)-L-lysine (CHEBI:165185) has functional parent N-benzoylglycine (CHEBI:18089)
N2,N6-bis(2,3-Dihydroxybenzoyl)-L-lysine (CHEBI:165185) is a N-acylglycine (CHEBI:16180)
IUPAC Name 
(2S)-2,6-bis[(2,3-dihydroxybenzoyl)amino]hexanoic acid
Manual XrefsDatabases
168002ChemSpider
C06446KEGG COMPOUND
95BPDBeChem
Registry NumbersSources
CAS:23369-85-9ChemIDplus