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CHEBI:84277 - 2-methyltridecane

ChEBI IDCHEBI:84277
ChEBI Name2-methyltridecane
Stars
DefinitionA long-chain alkane that is tridecane substituted by a methyl group at position 2. Metabolite observed in cancer metabolism.
Last Modified14 January 2015
Submitternamrata
DownloadsMolfile
FormulaC14H30
Net Charge0
Average Mass198.394
Monoisotopic Mass198.23475
SMILESCCCCCCCCCCCC(C)C
InChIInChI=1S/C14H30/c1-4-5-6-7-8-9-10-11-12-13-14(2)3/h14H,4-13H2,1-3H3
InChIKeyCJBFZKZYIPBBTO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
- PubMed (25518943) Metabolite observed in cancer metabolism.
- MetaboLights (MTBLS150)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
2-methyltridecane (CHEBI:84277) has parent hydride tridecane (CHEBI:35998)
2-methyltridecane (CHEBI:84277) has role human metabolite (CHEBI:77746)
2-methyltridecane (CHEBI:84277) is a long-chain alkane (CHEBI:83563)
IUPAC Name 
2-methyltridecane
Registry NumbersSources
Reaxys:1733883Reaxys
CAS:1560-96-9ChemIDplus
Citations