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CHEBI:50717 - 1-methylnaphthalene

ChEBI IDCHEBI:50717
ChEBI Name1-methylnaphthalene
Stars
DefinitionA methylnaphthalene carrying a methyl substituent at position 1.
Secondary ChEBI IDsCHEBI:19066, CHEBI:34094
Last Modified3 February 2014
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC11H10
Net Charge0
Average Mass142.201
Monoisotopic Mass142.07825
SMILESCc1cccc2ccccc12
InChIInChI=1S/C11H10/c1-9-5-4-7-10-6-2-3-8-11(9)10/h2-8H,1H3
InChIKeyQPUYECUOLPXSFR-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
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.
ChEBI Ontology
Outgoing Relation(s)
1-methylnaphthalene (CHEBI:50717) has role carcinogenic agent (CHEBI:50903)
1-methylnaphthalene (CHEBI:50717) has role plant metabolite (CHEBI:76924)
1-methylnaphthalene (CHEBI:50717) is a methylnaphthalene (CHEBI:50715)
Synonyms  Source
1-MethylnaphthaleneKEGG COMPOUND
alpha-MethylnaphthaleneKEGG COMPOUND
α-methylnaphthaleneNIST Chemistry WebBook
Manual XrefsDatabases
c0713UM-BBD
C14082KEGG COMPOUND
HMDB0032860HMDB
1-MethylnaphthaleneWikipedia
Registry NumbersSources
Reaxys:506793Reaxys
CAS:90-12-0KEGG COMPOUND
CAS:90-12-0NIST Chemistry WebBook
CAS:90-12-0ChemIDplus
Citations