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CHEBI:161751 - Cys-Trp-Gln

ChEBI IDCHEBI:161751
ChEBI NameCys-Trp-Gln
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H25N5O5S
Net Charge0
Average Mass435.506
Monoisotopic Mass435.15764
SMILESNC(=O)CC[C@H](NC(=O)[C@H](Cc1cnc2ccccc12)NC(=O)[C@@H](N)CS)C(=O)O
InChIInChI=1S/C19H25N5O5S/c20-12(9-30)17(26)24-15(7-10-8-22-13-4-2-1-3-11(10)13)18(27)23-14(19(28)29)5-6-16(21)25/h1-4,8,12,14-15,22,30H,5-7,9,20H2,(H2,21,25)(H,23,27)(H,24,26)(H,28,29)/t12-,14-,15-/m0/s1
InChIKeyXKDHARKYRGHLKO-QEJZJMRPSA-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)
Cys-Trp-Gln (CHEBI:161751) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-5-amino-2-[[(2S)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-5-oxopentanoic acid