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CHEBI:160397 - Asp-Asp-Ala

ChEBI IDCHEBI:160397
ChEBI NameAsp-Asp-Ala
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H17N3O8
Net Charge0
Average Mass319.270
Monoisotopic Mass319.10156
SMILESC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)O
InChIInChI=1S/C11H17N3O8/c1-4(11(21)22)13-10(20)6(3-8(17)18)14-9(19)5(12)2-7(15)16/h4-6H,2-3,12H2,1H3,(H,13,20)(H,14,19)(H,15,16)(H,17,18)(H,21,22)/t4-,5-,6-/m0/s1
InChIKeyNAPNAGZWHQHZLG-ZLUOBGJFSA-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-Asp-Ala (CHEBI:160397) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-amino-4-[[(2S)-3-carboxy-1-[[(1S)-1-carboxyethyl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid
Manual XrefsDatabases
57488823ChemSpider