CHEBI:161481 - Phe-Glu-Cys

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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 Phe-Glu-Cys
ChEBI ID CHEBI:161481
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H23N3O6S
Net Charge 0
Average Mass 397.450
Monoisotopic Mass 397.13076
InChI InChI=1S/C17H23N3O6S/c18-11(8-10-4-2-1-3-5-10)15(23)19-12(6-7-14(21)22)16(24)20-13(9-27)17(25)26/h1-5,11-13,27H,6-9,18H2,(H,19,23)(H,20,24)(H,21,22)(H,25,26)/t11-,12-,13-/m0/s1
InChIKey UEADQPLTYBWWTG-AVGNSLFASA-N
SMILES SC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)CCC(O)=O)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 Phe-Glu-Cys (CHEBI:161481) is a oligopeptide (CHEBI:25676)
IUPAC Name
(4S)-4-[[(2S)-2-amino-3-phenylpropanoyl]amino]-5-[[(1R)-1-carboxy-2-sulanylethyl]amino]-5-oxopentanoic acid