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CHEBI:35998 - tridecane

ChEBI IDCHEBI:35998
ChEBI Nametridecane
Stars
DefinitionA straight chain alkane containing 13 carbon atoms. It forms a component of the essential oils isolated from plants such as Abelmoschus esculentus.
Secondary ChEBI IDsCHEBI:32901, CHEBI:35025, CHEBI:46104
Last Modified20 September 2023
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC13H28
Net Charge0
Average Mass184.367
Monoisotopic Mass184.21910
SMILESCCCCCCCCCCCCC
InChIInChI=1S/C13H28/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3-13H2,1-2H3
InChIKeyIIYFAKIEWZDVMP-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Abelmoschus esculentus (ncbitaxon:455045) - PubMed (23768323)
Roles Classification
Biological Roles:
volatile oil component  Any plant metabolite that is found naturally as a component of a volatile oil.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
tridecane (CHEBI:35998) has role plant metabolite (CHEBI:76924)
tridecane (CHEBI:35998) has role volatile oil component (CHEBI:27311)
tridecane (CHEBI:35998) is a long-chain alkane (CHEBI:83563)
Incoming Relation(s)
12-methyltridecan-1-ol (CHEBI:84909) has parent hydride tridecane (CHEBI:35998)
2-methyltridecane (CHEBI:84277) has parent hydride tridecane (CHEBI:35998)
tridecan-2-one (CHEBI:77928) has parent hydride tridecane (CHEBI:35998)
tridecanal (CHEBI:89816) has parent hydride tridecane (CHEBI:35998)
tridecanol (CHEBI:195620) has parent hydride tridecane (CHEBI:35998)
tridecyl group (CHEBI:32908) is substituent group from tridecane (CHEBI:35998)
IUPAC Name 
tridecane
Synonyms  Source
TRIDECANEPDBeChem
n-tridecaneNIST Chemistry WebBook
CH3‒[CH2]11‒CH3IUPAC
TridekanChEBI
TridecaneKEGG COMPOUND
UniProt Name  Source
tridecaneUniProt
Manual XrefsDatabases
TRDPDBeChem
C13834KEGG COMPOUND
LMFA11000001LIPID MAPS
TridecaneWikipedia
HMDB0034284HMDB
Registry NumbersSources
Gmelin:1222217Gmelin
Beilstein:1733089Beilstein
Reaxys:1733089Reaxys
CAS:629-50-5ChemIDplus
CAS:629-50-5NIST Chemistry WebBook
Citations