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CHEBI:604731 - pyrraline

ChEBI IDCHEBI:604731
ChEBI Namepyrraline
Stars
DefinitionA pyrrole having formyl and hydroxymethyl substituents at positions 2 and 5 respectively; useful as indicator of advanced stages of the Maillard reaction, which produces advanced glycation end-products (AGEs).
Last Modified22 August 2017
DownloadsMolfile
FormulaC6H7NO2
Net Charge0
Average Mass125.127
Monoisotopic Mass125.04768
SMILES[H]C(=O)c1ccc(CO)n1
InChIInChI=1S/C6H7NO2/c8-3-5-1-2-6(4-9)7-5/h1-3,7,9H,4H2
InChIKeySRPREECLSOIPNK-UHFFFAOYSA-N
Roles Classification
Biological Role:
hapten  Any substance capable of eliciting an immune response only when attached to a large carrier such as a protein. Examples include dinitrophenols; oligosaccharides; peptides; and heavy metals.
ChEBI Ontology
Outgoing Relation(s)
pyrraline (CHEBI:604731) has role hapten (CHEBI:59174)
pyrraline (CHEBI:604731) is a aldehyde (CHEBI:17478)
pyrraline (CHEBI:604731) is a aromatic primary alcohol (CHEBI:33857)
pyrraline (CHEBI:604731) is a pyrroles (CHEBI:26455)
Incoming Relation(s)
N-substituted pyrraline (CHEBI:131546) has functional parent pyrraline (CHEBI:604731)
IUPAC Name 
5-(hydroxymethyl)-1H-pyrrole-2-carbaldehyde
Synonyms  Source
5-(hydroxymethyl)pyrrole-2-carboxaldehydeChEMBL
2-Amino-6-(2-formyl-5-hydroxymethylpyrrol-1-yl)hexanoic acidChemIDplus
2-FhmpnChemIDplus
2-Formyl-5-(hydroxymethyl)pyrrole-1-norleucineChemIDplus
2-amino-6-(2-formyl-5-hydroxymethyl-1-pyrrolyl)-hexanoic acidChEBI
Registry NumbersSources
Beilstein:1524599Beilstein
Citations