EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:164434 - His-Glu-Asp

ChEBI IDCHEBI:164434
ChEBI NameHis-Glu-Asp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H21N5O8
Net Charge0
Average Mass399.360
Monoisotopic Mass399.13901
SMILESN[C@@H](Cc1cncn1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O
InChIInChI=1S/C15H21N5O8/c16-8(3-7-5-17-6-18-7)13(25)19-9(1-2-11(21)22)14(26)20-10(15(27)28)4-12(23)24/h5-6,8-10H,1-4,16H2,(H,17,18)(H,19,25)(H,20,26)(H,21,22)(H,23,24)(H,27,28)/t8-,9-,10-/m0/s1
InChIKeySDTPKSOWFXBACN-GUBZILKMSA-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)
His-Glu-Asp (CHEBI:164434) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-4-carboxybutanoyl]amino]butanedioic acid