CHEBI:162362 - Pro-His-Phe

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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-His-Phe
ChEBI ID CHEBI:162362
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H25N5O4
Net Charge 0
Average Mass 399.451
Monoisotopic Mass 399.19065
InChI InChI=1S/C20H25N5O4/c26-18(15-7-4-8-22-15)24-16(10-14-11-21-12-23-14)19(27)25-17(20(28)29)9-13-5-2-1-3-6-13/h1-3,5-6,11-12,15-17,22H,4,7-10H2,(H,21,23)(H,24,26)(H,25,27)(H,28,29)/t15-,16-,17-/m0/s1
InChIKey XQHGISDMVBTGAL-ULQDDVLXSA-N
SMILES O=C(N[C@@H](CC=1NC=NC1)C(=O)N[C@@H](CC2=CC=CC=C2)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 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Pro-His-Phe (CHEBI:162362) is a oligopeptide (CHEBI:25676)
IUPAC Name
(2S)-2-[[(2S)-3-(1H-imidazol-5-yl)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]amino]-3-phenylpropanoic acid
Manual Xref Database
5731263 ChemSpider
View more database links