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CHEBI:84221 - 1-ethyl-2-propylcyclohexane

ChEBI IDCHEBI:84221
ChEBI Name1-ethyl-2-propylcyclohexane
Stars
DefinitionA cycloalkane that is cyclohexane substituted by an ethyl and a propyl group at positions 1 and 2 respectively. Metabolite observed in cancer metabolism.
Last Modified14 January 2015
Submitternamrata
DownloadsMolfile
FormulaC11H22
Net Charge0
Average Mass154.297
Monoisotopic Mass154.17215
SMILESCCCC1CCCCC1CC
InChIInChI=1S/C11H22/c1-3-7-11-9-6-5-8-10(11)4-2/h10-11H,3-9H2,1-2H3
InChIKeyNNNKGLVDUYFBHS-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)
1-ethyl-2-propylcyclohexane (CHEBI:84221) has parent hydride cyclohexane (CHEBI:29005)
1-ethyl-2-propylcyclohexane (CHEBI:84221) has role human metabolite (CHEBI:77746)
1-ethyl-2-propylcyclohexane (CHEBI:84221) is a cycloalkane (CHEBI:23453)
IUPAC Name 
1-ethyl-2-propylcyclohexane
Registry NumbersSources
Reaxys:3230958Reaxys
Citations