EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:158095 - Ala-Gln-Arg

Default Structure
ChEBI IDCHEBI:158095
ChEBI NameAla-Gln-Arg
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H27N7O5
Net Charge0
Average Mass373.414
Monoisotopic Mass373.20737
SMILESC[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O
InChIInChI=1S/C14H27N7O5/c1-7(15)11(23)20-8(4-5-10(16)22)12(24)21-9(13(25)26)3-2-6-19-14(17)18/h7-9H,2-6,15H2,1H3,(H2,16,22)(H,20,23)(H,21,24)(H,25,26)(H4,17,18,19)/t7-,8-,9-/m0/s1
InChIKeyCXQODNIBUNQWAS-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)
Ala-Gln-Arg (CHEBI:158095) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-aminopropanoyl]amino]-5-oxopentanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Manual XrefsDatabases
16568528ChemSpider