EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:160091 - Asn-Ser-His

Default Structure
ChEBI IDCHEBI:160091
ChEBI NameAsn-Ser-His
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H20N6O6
Net Charge0
Average Mass356.339
Monoisotopic Mass356.14443
SMILESNC(=O)C[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cncn1)C(=O)O
InChIInChI=1S/C13H20N6O6/c14-7(2-10(15)21)11(22)19-9(4-20)12(23)18-8(13(24)25)1-6-3-16-5-17-6/h3,5,7-9,20H,1-2,4,14H2,(H2,15,21)(H,16,17)(H,18,23)(H,19,22)(H,24,25)/t7-,8-,9-/m0/s1
InChIKeyDOURAOODTFJRIC-CIUDSAMLSA-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)
Asn-Ser-His (CHEBI:160091) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-3-hydroxypropanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid