CHEBI:162719 - Pro-Trp-Lys

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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 Pro-Trp-Lys
ChEBI ID CHEBI:162719
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H31N5O4
Net Charge 0
Average Mass 429.521
Monoisotopic Mass 429.23760
InChI InChI=1S/C22H31N5O4/c23-10-4-3-8-18(22(30)31)26-21(29)19(27-20(28)17-9-5-11-24-17)12-14-13-25-16-7-2-1-6-15(14)16/h1-2,6-7,13,17-19,24-25H,3-5,8-12,23H2,(H,26,29)(H,27,28)(H,30,31)/t17-,18-,19-/m0/s1
InChIKey FYXCBXDAMPEHIQ-FHWLQOOXSA-N
SMILES O=C(N[C@@H](CC=1C=2C(NC1)=CC=CC2)C(=O)N[C@@H](CCCCN)C(O)=O)[C@H]3NCCC3
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing Pro-Trp-Lys (CHEBI:162719) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-6-amino-2-[[(2S)-3-(1H-indol-3-yl)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]amino]hexanoic acid
Manual Xref Database
16574120 ChemSpider
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