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CHEBI:161140 - Cys-Arg-Trp

ChEBI IDCHEBI:161140
ChEBI NameCys-Arg-Trp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H29N7O4S
Net Charge0
Average Mass463.564
Monoisotopic Mass463.20017
SMILESNC(N)=NCCC[C@H](NC(=O)[C@@H](N)CS)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C20H29N7O4S/c21-13(10-32)17(28)26-15(6-3-7-24-20(22)23)18(29)27-16(19(30)31)8-11-9-25-14-5-2-1-4-12(11)14/h1-2,4-5,9,13,15-16,25,32H,3,6-8,10,21H2,(H,26,28)(H,27,29)(H,30,31)(H4,22,23,24)/t13-,15-,16-/m0/s1
InChIKeyBNRHLRWCERLRTQ-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-Arg-Trp (CHEBI:161140) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-(1H-indol-3-yl)propanoic acid