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CHEBI:164558 - Trp-Cys-Asn

Default Structure
ChEBI IDCHEBI:164558
ChEBI NameTrp-Cys-Asn
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H23N5O5S
Net Charge0
Average Mass421.479
Monoisotopic Mass421.14199
SMILESNC(=O)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](N)Cc1cnc2ccccc12)C(=O)O
InChIInChI=1S/C18H23N5O5S/c19-11(5-9-7-21-12-4-2-1-3-10(9)12)16(25)23-14(8-29)17(26)22-13(18(27)28)6-15(20)24/h1-4,7,11,13-14,21,29H,5-6,8,19H2,(H2,20,24)(H,22,26)(H,23,25)(H,27,28)/t11-,13-,14-/m0/s1
InChIKeyHDQJVXVRGJUDML-UBHSHLNASA-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)
Trp-Cys-Asn (CHEBI:164558) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-4-amino-2-[[(2R)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-sulanylpropanoyl]amino]-4-oxobutanoic acid