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CHEBI:159635 - Asn-Cys-Ala

Default Structure
ChEBI IDCHEBI:159635
ChEBI NameAsn-Cys-Ala
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H18N4O5S
Net Charge0
Average Mass306.344
Monoisotopic Mass306.09979
SMILESC[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](N)CC(N)=O)C(=O)O
InChIInChI=1S/C10H18N4O5S/c1-4(10(18)19)13-9(17)6(3-20)14-8(16)5(11)2-7(12)15/h4-6,20H,2-3,11H2,1H3,(H2,12,15)(H,13,17)(H,14,16)(H,18,19)/t4-,5-,6-/m0/s1
InChIKeyXXAOXVBAWLMTDR-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)
Asn-Cys-Ala (CHEBI:159635) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2R)-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-3-sulanylpropanoyl]amino]propanoic acid