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CHEBI:161044 - Asp-Val-Ile

ChEBI IDCHEBI:161044
ChEBI NameAsp-Val-Ile
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H27N3O6
Net Charge0
Average Mass345.396
Monoisotopic Mass345.18999
SMILESCC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)O
InChIInChI=1S/C15H27N3O6/c1-5-8(4)12(15(23)24)18-14(22)11(7(2)3)17-13(21)9(16)6-10(19)20/h7-9,11-12H,5-6,16H2,1-4H3,(H,17,21)(H,18,22)(H,19,20)(H,23,24)/t8-,9-,11-,12-/m0/s1
InChIKeyUXRVDHVARNBOIO-QSFUFRPTSA-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-Val-Ile (CHEBI:161044) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3S)-2-[[(2S)-2-[[(2S)-2-amino-3-carboxypropanoyl]amino]-3-methylbutanoyl]amino]-3-methylpentanoic acid