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CHEBI:160833 - Asp-Pro-Asp

Default Structure
ChEBI IDCHEBI:160833
ChEBI NameAsp-Pro-Asp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H19N3O8
Net Charge0
Average Mass345.308
Monoisotopic Mass345.11721
SMILESN[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)O
InChIInChI=1S/C13H19N3O8/c14-6(4-9(17)18)12(22)16-3-1-2-8(16)11(21)15-7(13(23)24)5-10(19)20/h6-8H,1-5,14H2,(H,15,21)(H,17,18)(H,19,20)(H,23,24)/t6-,7-,8-/m0/s1
InChIKeyKESWRFKUZRUTAH-FXQIFTODSA-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)
Asp-Pro-Asp (CHEBI:160833) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-1-[(2S)-2-amino-3-carboxypropanoyl]pyrrolidine-2-carbonyl]amino]butanedioic acid