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CHEBI:160483 - Asp-Gln-Cys

ChEBI IDCHEBI:160483
ChEBI NameAsp-Gln-Cys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H20N4O7S
Net Charge0
Average Mass364.380
Monoisotopic Mass364.10527
SMILESNC(=O)CC[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CS)C(=O)O
InChIInChI=1S/C12H20N4O7S/c13-5(3-9(18)19)10(20)15-6(1-2-8(14)17)11(21)16-7(4-24)12(22)23/h5-7,24H,1-4,13H2,(H2,14,17)(H,15,20)(H,16,21)(H,18,19)(H,22,23)/t5-,6-,7-/m0/s1
InChIKeySMZCLQGDQMGESY-ACZMJKKPSA-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-Gln-Cys (CHEBI:160483) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-amino-4-[[(2S)-5-amino-1-[[(1R)-1-carboxy-2-sulanylethyl]amino]-1,5-dioxopentan-2-yl]amino]-4-oxobutanoic acid