EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:132991 - pyroglutamylvaline

ChEBI IDCHEBI:132991
ChEBI Namepyroglutamylvaline
Stars
DefinitionA dipeptide obtained by formal condensation of the carboxy group of pyroglutamic acid with the amino group of valine.
Last Modified19 August 2024
SubmitterSteve
DownloadsMolfile
FormulaC10H16N2O4
Net Charge0
Average Mass228.248
Monoisotopic Mass228.11101
SMILESCC(C)[C@H](NC(=O)[C@@H]1CCC(=O)N1)C(=O)O
InChIInChI=1S/C10H16N2O4/c1-5(2)8(10(15)16)12-9(14)6-3-4-7(13)11-6/h5-6,8H,3-4H2,1-2H3,(H,11,13)(H,12,14)(H,15,16)/t6-,8-/m0/s1
InChIKeyDTSWLLBBGHRXQH-XPUUQOCRSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
pyroglutamylvaline (CHEBI:132991) has functional parent L-valine (CHEBI:16414)
pyroglutamylvaline (CHEBI:132991) has functional parent 5-oxo-L-proline (CHEBI:18183)
pyroglutamylvaline (CHEBI:132991) is a dipeptide (CHEBI:46761)
pyroglutamylvaline (CHEBI:132991) is conjugate acid of pyroglutamylvalinate (CHEBI:132993)
Incoming Relation(s)
pyroglutamylvalinate (CHEBI:132993) is conjugate base of pyroglutamylvaline (CHEBI:132991)
IUPAC Name 
5-oxo-L-prolyl-L-valine
Synonyms  Source
p-Glu-ValChEBI
5-oxoprolylvalineChEBI
Pyro-glu-valChemIDplus
Pyroglutamyl valineChemIDplus
L-pyroglutamyl-L-valineChEBI
Registry NumbersSources
Reaxys:26522098Reaxys
CAS:21282-10-0ChemIDplus