EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:162186 - Gln-His-Cys

Default Structure
ChEBI IDCHEBI:162186
ChEBI NameGln-His-Cys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H22N6O5S
Net Charge0
Average Mass386.434
Monoisotopic Mass386.13724
SMILESNC(=O)CC[C@H](N)C(=O)N[C@@H](Cc1cncn1)C(=O)N[C@@H](CS)C(=O)O
InChIInChI=1S/C14H22N6O5S/c15-8(1-2-11(16)21)12(22)19-9(3-7-4-17-6-18-7)13(23)20-10(5-26)14(24)25/h4,6,8-10,26H,1-3,5,15H2,(H2,16,21)(H,17,18)(H,19,22)(H,20,23)(H,24,25)/t8-,9-,10-/m0/s1
InChIKeyJNEITCMDYWKPIW-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)
Gln-His-Cys (CHEBI:162186) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2R)-2-[[(2S)-2-[[(2S)-2,5-diamino-5-oxopentanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-3-sulanylpropanoic acid