EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:163257 - Glu-Thr-Asp

ChEBI IDCHEBI:163257
ChEBI NameGlu-Thr-Asp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H21N3O9
Net Charge0
Average Mass363.323
Monoisotopic Mass363.12778
SMILESC[C@@H](O)[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O
InChIInChI=1S/C13H21N3O9/c1-5(17)10(16-11(22)6(14)2-3-8(18)19)12(23)15-7(13(24)25)4-9(20)21/h5-7,10,17H,2-4,14H2,1H3,(H,15,23)(H,16,22)(H,18,19)(H,20,21)(H,24,25)/t5-,6+,7+,10+/m1/s1
InChIKeyBDISFWMLMNBTGP-NUMRIWBASA-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)
Glu-Thr-Asp (CHEBI:163257) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S,3R)-2-[[(2S)-2-amino-4-carboxybutanoyl]amino]-3-hydroxybutanoyl]amino]butanedioic acid