EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:165055 - Tyr-Glu-Asp

ChEBI IDCHEBI:165055
ChEBI NameTyr-Glu-Asp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H23N3O9
Net Charge0
Average Mass425.394
Monoisotopic Mass425.14343
SMILESN[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O
InChIInChI=1S/C18H23N3O9/c19-11(7-9-1-3-10(22)4-2-9)16(27)20-12(5-6-14(23)24)17(28)21-13(18(29)30)8-15(25)26/h1-4,11-13,22H,5-8,19H2,(H,20,27)(H,21,28)(H,23,24)(H,25,26)(H,29,30)/t11-,12-,13-/m0/s1
InChIKeyHKYTWJOWZTWBQB-AVGNSLFASA-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)
Tyr-Glu-Asp (CHEBI:165055) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-carboxybutanoyl]amino]butanedioic acid
Manual XrefsDatabases
23271497ChemSpider