CHEBI:35998 - tridecane

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ChEBI Name tridecane
ChEBI ID CHEBI:35998
Definition A straight chain alkane containing 13 carbon atoms. It forms a component of the essential oils isolated from plants such as Abelmoschus esculentus.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:35025, CHEBI:46104, CHEBI:32901
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Formula C13H28
Net Charge 0
Average Mass 184.36142
Monoisotopic Mass 184.219
InChI InChI=1S/C13H28/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3-13H2,1-2H3
InChIKey IIYFAKIEWZDVMP-UHFFFAOYSA-N
SMILES CCCCCCCCCCCCC
Metabolite of Species Details
Abelmoschus esculentus (NCBI:txid455045) See: PubMed
Roles Classification
Biological Role(s): 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 metabolite that is found naturally as a component of a volatile oil.
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ChEBI Ontology
Outgoing 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 12-methyltridecan-1-ol (CHEBI:84909) has parent hydride tridecane (CHEBI:35998)
2-methyltridecane (CHEBI:84277) has parent hydride tridecane (CHEBI:35998)
7-tridecanol (CHEBI:87311) has parent hydride tridecane (CHEBI:35998)
tridecan-2-one (CHEBI:77928) has parent hydride tridecane (CHEBI:35998)
tridecyl group (CHEBI:32908) is substituent group from tridecane (CHEBI:35998)
IUPAC Name
tridecane
Synonyms Sources
CH3‒[CH2]11‒CH3 IUPAC
n-tridecane NIST Chemistry WebBook
TRIDECANE PDBeChem
Tridecane KEGG COMPOUND
Tridekan ChEBI
Manual Xrefs Databases
C13834 KEGG COMPOUND
HMDB0034284 HMDB
LMFA11000001 LIPID MAPS
TRD PDBeChem
Tridecane Wikipedia
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Registry Numbers Types Sources
1222217 Gmelin Registry Number Gmelin
1733089 Beilstein Registry Number Beilstein
1733089 Reaxys Registry Number Reaxys
629-50-5 CAS Registry Number ChemIDplus
629-50-5 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
23768323 PubMed citation Europe PMC
24010324 PubMed citation Europe PMC
Last Modified
23 October 2015