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indole-3-glyoxal

PropertiesImage
MNX_IDMNXM8734 Image of MNXM8734
referencechebi:133418
formulaC10H7NO2
global charge0
mol weight173.171
InChIKeyKPDBTUMJILFRNQ-UHFFFAOYSA-N
InChIInChI=1S/C10H7NO2/c12-6-10(13)8-5-11-9-4-2-1-3-7(8)9/h1-6,11H
SMILESO=CC(=O)C1=CNC2=CC=CC=C21
MNX internals
InChI (mnx)InChI=1/C10H7NO2/c12-6-10(13)8-5-11-9-4-2-1-3-7(8)9/h1-6,11H Image of MNXM8734
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[C:9]2[C:7](=[CH:3]1)[C:8]([C:10]([CH:6]=[O:12])=[O:13])=[CH:5][NH:11]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:133418
chebi:133418
KPDBTUMJILFRNQ-UHFFFAOYSA-N 		indole-3-glyoxal
(1H-indol-3-yl)(oxo)acetaldehyde
(indol-3-yl)(oxo)acetaldehyde
2-(indol-3-yl)-2-oxoacetaldehyde
3-glyoxalylindole
3-indoleglyoxal
3-indolylglyoxal
indol-3-ylglyoxal

metacyc.compound:3-INDOLEGLYOXAL
metacycM:3-INDOLEGLYOXAL
KPDBTUMJILFRNQ-UHFFFAOYSA-N 		(indol-3-yl)glyoxal
3-indoleglyoxal
indole-3-glyoxal

seed.compound:cpd22023
seedM:cpd22023
KPDBTUMJILFRNQ-UHFFFAOYSA-N 		3-indoleglyoxal
indole-3-glyoxal

seedM:M_cpd22023 		secondary/obsolete/fantasy identifier