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1-methylimidazole-4-acetaldehyde

PropertiesImage
MNX_IDMNXM5416 Image of MNXM5416
referencechebi:28104
formulaC6H8N2O
global charge0
mol weight124.143
InChIKeyGCQHUBANENYTLB-UHFFFAOYSA-N
InChIInChI=1S/C6H8N2O/c1-8-4-6(2-3-9)7-5-8/h3-5H,2H2,1H3
SMILESCN1C=NC(CC=O)=C1
MNX internals
InChI (mnx)InChI=1/C6H8N2O/c1-8-4-6(2-3-9)7-5-8/h3-5H,2H2,1H3 Image of MNXM5416
SMILES (mnx)[CH3:1][N:8]1[CH:4]=[C:6]([CH2:2][CH:3]=[O:9])[N:7]=[CH:5]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 3
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:28104
chebi:28104
GCQHUBANENYTLB-UHFFFAOYSA-N 		1-methylimidazole-4-acetaldehyde
(1-methyl-1H-imidazol-4-yl)acetaldehyde
1-Methylimidazole-4-acetaldehyde
Methylimidazole acetaldehyde
Methylimidazoleacetaldehyde

vmhM:3mldz
vmhmetabolite:3mldz
GCQHUBANENYTLB-UHFFFAOYSA-N 		1-methylimidazole-4-acetaldehyde
2-(1-methyl-1H-imidazol-4-yl)acetaldehyde

bigg.metabolite:3mldz
biggM:3mldz
GCQHUBANENYTLB-UHFFFAOYSA-N 		3-Methylimidazole acetaldehyde
hmdb:HMDB0004181
GCQHUBANENYTLB-UHFFFAOYSA-N 		Methylimidazole acetaldehyde
1-Methylimidazol-3-ylacetaldehyde
1-Methylimidazole-4-acetaldehyde
2-(1-methyl-1H-imidazol-4-yl)acetaldehyde
Methylimidazoleacetaldehyde
N-Methylimidazole-3-acetaldehyde
methylimidazole acetaldehyde

kegg.compound:C05827
keggC:C05827
GCQHUBANENYTLB-UHFFFAOYSA-N 		Methylimidazole acetaldehyde
1-Methylimidazole-4-acetaldehyde
Methylimidazoleacetaldehyde

seed.compound:cpd03458
seedM:cpd03458
GCQHUBANENYTLB-UHFFFAOYSA-N 		Methylimidazoleacetaldehyde
1-Methylimidazole-4-acetaldehyde
Methylimidazole acetaldehyde

hmdb:HMDB04181
chebi:1605
chebi:19063
chebi:20135
chebi:644
biggM:M_3mldz
keggC:M_C05827
seedM:M_cpd03458
vmhM:M_3mldz 		secondary/obsolete/fantasy identifier