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CHEBI:188836 - (4R)-4-{4-[(2-Anilino-2-oxoethyl)amino]-4-oxobutyl}-L-glutamic acid

ChEBI IDCHEBI:188836
ChEBI Name(4R)-4-{4-[(2-Anilino-2-oxoethyl)amino]-4-oxobutyl}-L-glutamic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H23N3O6
Net Charge0
Average Mass365.386
Monoisotopic Mass365.15869
SMILESN[C@@H](C[C@@H](CCCC(=O)NCC(=O)Nc1ccccc1)C(=O)O)C(=O)O
InChIInChI=1S/C17H23N3O6/c18-13(17(25)26)9-11(16(23)24)5-4-8-14(21)19-10-15(22)20-12-6-2-1-3-7-12/h1-3,6-7,11,13H,4-5,8-10,18H2,(H,19,21)(H,20,22)(H,23,24)(H,25,26)/t11-,13+/m1/s1
InChIKeyXKVOHIXGSHTPCI-YPMHNXCESA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(4R)-4-{4-[(2-Anilino-2-oxoethyl)amino]-4-oxobutyl}-L-glutamic acid (CHEBI:188836) is a N-acyl-amino acid (CHEBI:51569)
IUPAC Name 
(2S,4R)-2-amino-4-[4-[(2-anilino-2-oxoethyl)amino]-4-oxobutyl]pentanedioic acid
Manual XrefsDatabases
4449785ChemSpider