EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:162550 - Gln-Trp-His

ChEBI IDCHEBI:162550
ChEBI NameGln-Trp-His
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H27N7O5
Net Charge0
Average Mass469.502
Monoisotopic Mass469.20737
SMILESNC(=O)CC[C@H](N)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)N[C@@H](Cc1cncn1)C(=O)O
InChIInChI=1S/C22H27N7O5/c23-15(5-6-19(24)30)20(31)28-17(7-12-9-26-16-4-2-1-3-14(12)16)21(32)29-18(22(33)34)8-13-10-25-11-27-13/h1-4,9-11,15,17-18,26H,5-8,23H2,(H2,24,30)(H,25,27)(H,28,31)(H,29,32)(H,33,34)/t15-,17-,18-/m0/s1
InChIKeyFVEMBYKESRUFBG-SZMVWBNQSA-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)
Gln-Trp-His (CHEBI:162550) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid