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CHEBI:159632 - Asn-Asp-Val

ChEBI IDCHEBI:159632
ChEBI NameAsn-Asp-Val
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Last Modified20 March 2025
SubmitterMetaboLights
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FormulaC13H22N4O7
Net Charge0
Average Mass346.340
Monoisotopic Mass346.14885
SMILESCC(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(N)=O)C(=O)O
InChIInChI=1S/C13H22N4O7/c1-5(2)10(13(23)24)17-12(22)7(4-9(19)20)16-11(21)6(14)3-8(15)18/h5-7,10H,3-4,14H2,1-2H3,(H2,15,18)(H,16,21)(H,17,22)(H,19,20)(H,23,24)/t6-,7-,10-/m0/s1
InChIKeyIYVSIZAXNLOKFQ-BYULHYEWSA-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-Asp-Val (CHEBI:159632) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-3-carboxy-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]propanoyl]amino]-3-methylbutanoic acid