CHEBI:40035 - 4-methylimidazole

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ChEBI Name 4-methylimidazole
ChEBI ID CHEBI:40035
Definition Imidazole substituted at position 4 by a methyl group.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C4H6N2
Net Charge 0
Average Mass 82.10380
Monoisotopic Mass 82.05310
InChI InChI=1S/C4H6N2/c1-4-2-5-3-6-4/h2-3H,1H3,(H,5,6)
InChIKey XLSZMDLNRCVEIJ-UHFFFAOYSA-N
SMILES Cc1c[nH]cn1
Roles Classification
Chemical Role(s): reaction intermediate
Any chemical substance produced during the conversion of a reactant to a product.
Biological Role(s): carcinogenic agent
A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities.
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ChEBI Ontology
Outgoing 4-methylimidazole (CHEBI:40035) has role carcinogenic agent (CHEBI:50903)
4-methylimidazole (CHEBI:40035) has role reaction intermediate (CHEBI:64297)
4-methylimidazole (CHEBI:40035) is a imidazoles (CHEBI:24780)
IUPAC Name
4-methyl-1H-imidazole
Synonyms Sources
4(5)-methylimidazole ChEBI
4-Me-i ChemIDplus
4-MEI ChEBI
4-METHYLIMIDAZOLE PDBeChem
4MI ChEBI
Manual Xrefs Databases
4-Methylimidazole Wikipedia
4MZ PDBeChem
C19262 KEGG COMPOUND
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Registry Numbers Types Sources
1453 Reaxys Registry Number Reaxys
822-36-6 CAS Registry Number NIST Chemistry WebBook
822-36-6 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
16180012 PubMed citation Europe PMC
17619857 PubMed citation Europe PMC
2079523 PubMed citation Europe PMC
2254202 PubMed citation Europe PMC
24161 PubMed citation Europe PMC
Last Modified
04 August 2014