EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:163823 - Thr-Gln-His

ChEBI IDCHEBI:163823
ChEBI NameThr-Gln-His
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24N6O6
Net Charge0
Average Mass384.393
Monoisotopic Mass384.17573
SMILESC[C@@H](O)[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1cncn1)C(=O)O
InChIInChI=1S/C15H24N6O6/c1-7(22)12(17)14(25)20-9(2-3-11(16)23)13(24)21-10(15(26)27)4-8-5-18-6-19-8/h5-7,9-10,12,22H,2-4,17H2,1H3,(H2,16,23)(H,18,19)(H,20,25)(H,21,24)(H,26,27)/t7-,9+,10+,12+/m1/s1
InChIKeyGUZGCDIZVGODML-NKIYYHGXSA-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)
Thr-Gln-His (CHEBI:163823) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-5-amino-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-5-oxopentanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid