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CHEBI:195626 - tridecan-4-ol

ChEBI IDCHEBI:195626
ChEBI Nametridecan-4-ol
Stars
DefinitionA secondary alcohol that is tridecane substituted by a hydroxy group at position 4.
Last Modified25 August 2023
SubmitterAdnan
DownloadsMolfile
FormulaC13H28O
Net Charge0
Average Mass200.366
Monoisotopic Mass200.21402
SMILESCCCCCCCCCC(O)CCC
InChIInChI=1S/C13H28O/c1-3-5-6-7-8-9-10-12-13(14)11-4-2/h13-14H,3-12H2,1-2H3
InChIKeyVHNLHPIEIIHMHH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mandragora autumnalis (ncbitaxon:389206) fruit (BTO:0000486) DOI (10.1002/cbdv.201900345)
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.
volatile oil component  Any plant metabolite that is found naturally as a component of a volatile oil.
ChEBI Ontology
Outgoing Relation(s)
tridecan-4-ol (CHEBI:195626) has role plant metabolite (CHEBI:76924)
tridecan-4-ol (CHEBI:195626) has role volatile oil component (CHEBI:27311)
tridecan-4-ol (CHEBI:195626) is a secondary alcohol (CHEBI:35681)
tridecan-4-ol (CHEBI:195626) is a tridecanol (CHEBI:195620)
IUPAC Name 
tridecan-4-ol
Synonyms  Source
4-tridecanolNIST Chemistry WebBook
4-hydroxytridecaneChEBI
4-tridecyl alcoholChEBI
Manual XrefsDatabases
C00052725KNApSAcK
Registry NumbersSources
CAS:26215-92-9NIST Chemistry WebBook
Citations