EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:162150 - Pro-Asp-Glu

ChEBI IDCHEBI:162150
ChEBI NamePro-Asp-Glu
Stars
Last Modified26 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H21N3O8
Net Charge0
Average Mass359.335
Monoisotopic Mass359.13286
SMILESO=C(O)CC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)O
InChIInChI=1S/C14H21N3O8/c18-10(19)4-3-8(14(24)25)16-13(23)9(6-11(20)21)17-12(22)7-2-1-5-15-7/h7-9,15H,1-6H2,(H,16,23)(H,17,22)(H,18,19)(H,20,21)(H,24,25)/t7-,8-,9-/m0/s1
InChIKeyVJLJGKQAOQJXJG-CIUDSAMLSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Pro-Asp-Glu (CHEBI:162150) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-3-carboxy-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]amino]pentanedioic acid