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CHEBI:166106 - Val-Asn-Met

ChEBI IDCHEBI:166106
ChEBI NameVal-Asn-Met
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H26N4O5S
Net Charge0
Average Mass362.452
Monoisotopic Mass362.16239
SMILESCSCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)C(C)C)C(=O)O
InChIInChI=1S/C14H26N4O5S/c1-7(2)11(16)13(21)18-9(6-10(15)19)12(20)17-8(14(22)23)4-5-24-3/h7-9,11H,4-6,16H2,1-3H3,(H2,15,19)(H,17,20)(H,18,21)(H,22,23)/t8-,9-,11-/m0/s1
InChIKeyNWDOPHYLSORNEX-QXEWZRGKSA-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)
Val-Asn-Met (CHEBI:166106) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-4-oxobutanoyl]amino]-4-methylsulanylbutanoic acid