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> Main
CHEBI:27398 - imidazole-4-acetaldehyde
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ChEBI Ontology
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ChEBI Name
imidazole-4-acetaldehyde
ChEBI ID
CHEBI:27398
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:5874, CHEBI:24775
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Formula
C5H6N2O
Net Charge
0
Average Mass
110.11402
Monoisotopic Mass
110.04801
InChI
InChI=1S/C5H6N2O/c8-2-1-5-3-6-4-7-5/h2-4H,1H2,(H,6,7)
InChIKey
MQSRGWNVEZRLDK-UHFFFAOYSA-N
SMILES
O=CCc1c[nH]cn1
Metabolite of Species
Details
Mus musculus
(NCBI:txid10090)
Source: BioModels - MODEL1507180067 See:
PubMed
Homo sapiens
(NCBI:txid9606)
See:
DOI
Roles Classification
Biological Role
(s):
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (
Mus musculus
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
imidazole-4-acetaldehyde (
CHEBI:27398
)
has role
human metabolite (
CHEBI:77746
)
imidazole-4-acetaldehyde (
CHEBI:27398
)
has role
mouse metabolite (
CHEBI:75771
)
imidazole-4-acetaldehyde (
CHEBI:27398
)
is a
α-CH
2
-containing aldehyde (
CHEBI:73359
)
imidazole-4-acetaldehyde (
CHEBI:27398
)
is a
imidazolylacetaldehyde (
CHEBI:24779
)
IUPAC Name
1
H
-imidazol-4-ylacetaldehyde
Synonyms
Sources
1H-Imidazole-4-acetaldehyde
ChemIDplus
Imidazole acetaldehyde
KEGG COMPOUND
Imidazole-4-acetaldehyde
KEGG COMPOUND
imidazole-4-acetaldehyde
UniProt
Manual Xref
Database
C05130
KEGG COMPOUND
View more database links
Registry Number
Type
Source
645-14-7
CAS Registry Number
ChemIDplus
Last Modified
15 November 2016