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CHEBI:158687 - Arg-Ala-Asp

ChEBI IDCHEBI:158687
ChEBI NameArg-Ala-Asp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H24N6O6
Net Charge0
Average Mass360.371
Monoisotopic Mass360.17573
SMILESC[C@H](NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O
InChIInChI=1S/C13H24N6O6/c1-6(10(22)19-8(12(24)25)5-9(20)21)18-11(23)7(14)3-2-4-17-13(15)16/h6-8H,2-5,14H2,1H3,(H,18,23)(H,19,22)(H,20,21)(H,24,25)(H4,15,16,17)/t6-,7-,8-/m0/s1
InChIKeyMCYJBCKCAPERSE-FXQIFTODSA-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)
Arg-Ala-Asp (CHEBI:158687) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]propanoyl]amino]butanedioic acid
Manual XrefsDatabases
8104451ChemSpider