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CHEBI:133418 - indole-3-glyoxal

ChEBI IDCHEBI:133418
ChEBI Nameindole-3-glyoxal
Stars
DefinitionA member of the class of indoles that is glyoxal in which one of the hydrogens has been replaced by an indol-3-yl group.
Last Modified28 February 2017
Submittermwilliams
DownloadsMolfile
FormulaC10H7NO2
Net Charge0
Average Mass173.171
Monoisotopic Mass173.04768
SMILES[H]C(=O)C(=O)c1cnc2ccccc12
InChIInChI=1S/C10H7NO2/c12-6-10(13)8-5-11-9-4-2-1-3-7(8)9/h1-6,11H
InChIKeyKPDBTUMJILFRNQ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Glycine max (ncbitaxon:3847)
seed (BTO:0001226) PubMed (25369450)
seed (BTO:0001226) MetaboLights (MTBLS118)
seed (BTO:0001226) MetaboLights (MTBLS117)
ChEBI Ontology
Outgoing Relation(s)
indole-3-glyoxal (CHEBI:133418) has functional parent glyoxal (CHEBI:34779)
indole-3-glyoxal (CHEBI:133418) is a 2-oxo aldehyde (CHEBI:27659)
indole-3-glyoxal (CHEBI:133418) is a aromatic ketone (CHEBI:76224)
indole-3-glyoxal (CHEBI:133418) is a indoles (CHEBI:24828)
IUPAC Name 
(1H-indol-3-yl)(oxo)acetaldehyde
Synonyms  Source
indol-3-ylglyoxalChEBI
3-glyoxalylindoleChEBI
3-indolylglyoxalChEBI
3-indoleglyoxalMetaCyc
(indol-3-yl)(oxo)acetaldehydeChEBI
2-(indol-3-yl)-2-oxoacetaldehydeChEBI
Manual XrefsDatabases
10471239ChemSpider
3-INDOLEGLYOXALMetaCyc
Registry NumbersSources
Reaxys:1526514Reaxys
Citations