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CHEBI:160317 - Asp-Arg-Ala

ChEBI IDCHEBI:160317
ChEBI NameAsp-Arg-Ala
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H24N6O6
Net Charge0
Average Mass360.371
Monoisotopic Mass360.17573
SMILESC[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(=O)O)C(=O)O
InChIInChI=1S/C13H24N6O6/c1-6(12(24)25)18-11(23)8(3-2-4-17-13(15)16)19-10(22)7(14)5-9(20)21/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
InChIKeyOERMIMJQPQUIPK-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)
Asp-Arg-Ala (CHEBI:160317) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-amino-4-[[(2S)-1-[[(1S)-1-carboxyethyl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-4-oxobutanoic acid