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CHEBI:160443 - Asp-Cys-Asp

ChEBI IDCHEBI:160443
ChEBI NameAsp-Cys-Asp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H17N3O8S
Net Charge0
Average Mass351.337
Monoisotopic Mass351.07364
SMILESN[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)O)C(=O)O
InChIInChI=1S/C11H17N3O8S/c12-4(1-7(15)16)9(19)14-6(3-23)10(20)13-5(11(21)22)2-8(17)18/h4-6,23H,1-3,12H2,(H,13,20)(H,14,19)(H,15,16)(H,17,18)(H,21,22)/t4-,5-,6-/m0/s1
InChIKeyMJKBOVWWADWLHV-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-Cys-Asp (CHEBI:160443) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2R)-2-[[(2S)-2-amino-3-carboxypropanoyl]amino]-3-sulanylpropanoyl]amino]butanedioic acid