CHEBI:161766 - Cys-Trp-Phe

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Cys-Trp-Phe
ChEBI ID CHEBI:161766
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H26N4O4S
Net Charge 0
Average Mass 454.550
Monoisotopic Mass 454.16748
InChI InChI=1S/C23H26N4O4S/c24-17(13-32)21(28)26-19(11-15-12-25-18-9-5-4-8-16(15)18)22(29)27-20(23(30)31)10-14-6-2-1-3-7-14/h1-9,12,17,19-20,25,32H,10-11,13,24H2,(H,26,28)(H,27,29)(H,30,31)/t17-,19-,20-/m0/s1
InChIKey NMPSRDYYNIYOSJ-IHPCNDPISA-N
SMILES SC[C@H](N)C(=O)N[C@@H](CC=1C=2C(NC1)=CC=CC2)C(=O)N[C@@H](CC3=CC=CC=C3)C(O)=O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Cys-Trp-Phe (CHEBI:161766) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-phenylpropanoic acid