EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:159385 - Arg-Trp-Ser

ChEBI IDCHEBI:159385
ChEBI NameArg-Trp-Ser
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H29N7O5
Net Charge0
Average Mass447.496
Monoisotopic Mass447.22302
SMILESNC(N)=NCCC[C@H](N)C(=O)N[C@@H](Cc1cnc2ccccc12)C(=O)N[C@@H](CO)C(=O)O
InChIInChI=1S/C20H29N7O5/c21-13(5-3-7-24-20(22)23)17(29)26-15(18(30)27-16(10-28)19(31)32)8-11-9-25-14-6-2-1-4-12(11)14/h1-2,4,6,9,13,15-16,25,28H,3,5,7-8,10,21H2,(H,26,29)(H,27,30)(H,31,32)(H4,22,23,24)/t13-,15-,16-/m0/s1
InChIKeyXMGVWQWEWWULNS-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)
Arg-Trp-Ser (CHEBI:159385) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-hydroxypropanoic acid