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CHEBI:161778 - Cys-Trp-Val

ChEBI IDCHEBI:161778
ChEBI NameCys-Trp-Val
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H26N4O4S
Net Charge0
Average Mass406.508
Monoisotopic Mass406.16748
SMILESCC(C)[C@H](NC(=O)[C@H](Cc1cnc2ccccc12)NC(=O)[C@@H](N)CS)C(=O)O
InChIInChI=1S/C19H26N4O4S/c1-10(2)16(19(26)27)23-18(25)15(22-17(24)13(20)9-28)7-11-8-21-14-6-4-3-5-12(11)14/h3-6,8,10,13,15-16,21,28H,7,9,20H2,1-2H3,(H,22,24)(H,23,25)(H,26,27)/t13-,15-,16-/m0/s1
InChIKeyQUQHPUMRFGFINP-BPUTZDHNSA-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-Val (CHEBI:161778) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-methylbutanoic acid