CHEBI:162076 - Pro-Arg-His

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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-Arg-His
ChEBI ID CHEBI:162076
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H28N8O4
Net Charge 0
Average Mass 408.463
Monoisotopic Mass 408.22335
InChI InChI=1S/C17H28N8O4/c18-17(19)22-6-2-4-12(24-14(26)11-3-1-5-21-11)15(27)25-13(16(28)29)7-10-8-20-9-23-10/h8-9,11-13,21H,1-7H2,(H,20,23)(H,24,26)(H,25,27)(H,28,29)(H4,18,19,22)/t11-,12-,13-/m0/s1
InChIKey QBFONMUYNSNKIX-AVGNSLFASA-N
SMILES O=C(N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC=1NC=NC1)C(O)=O)[C@H]2NCCC2
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-Arg-His (CHEBI:162076) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-2-[[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]pentanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid