tridec-1-ene-3,5,7,9,11-pentayne (CHEBI:9699)

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ChEBI Name	tridec-1-ene-3,5,7,9,11-pentayne

ChEBI ID	CHEBI:9699

Definition	A pentayne that is tridecane which carries a double bond at position 1 and triple bonds at positions 3,5,7,9 and 11. It is a natural product which exhibits ovicidal and nematicidal activities.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C13H6

Net Charge

Average Mass

162.191

Monoisotopic Mass

162.04695

InChI

InChI=1S/C13H6/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3H,1H2,2H3

InChIKey

KKBHBCOJHHCOCL-UHFFFAOYSA-N

SMILES

CC#CC#CC#CC#CC#CC=C

Metabolite of Species	Details
Cirsium palustre (NCBI:txid143190)	Present in trace amounts. See: PubMed
Ricinus communis (NCBI:txid3988)	See: PubMed
Bidens pilosa (NCBI:txid42337)	See: PubMed
Blumea lacera (NCBI:txid441183)	See: Book: Encyclopedia of Traditional Chinese Medicines - Molecular Structures, Pharmacological Activities, Natural Sources and Applications: Vol. 5, Springer Science & Business Media, 2011.
Cirsium japonicum (NCBI:txid516546)	Found in root (BTO:0001188). See: DOI
Echinacea purpurea (NCBI:txid53751)	Found in root (BTO:0001188). See: PubMed
Xanthium canadense (NCBI:txid552636)	Found in root (BTO:0001188). See: DOI

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. antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce. volatile oil component Any plant metabolite that is found naturally as a component of a volatile oil.

Application(s):	ovicide Any insecticide that is capable of killing egg cells. nematicide A substance used to destroy pests of the phylum Nematoda (roundworms).

ChEBI Ontology
Outgoing	tridec-1-ene-3,5,7,9,11-pentayne (CHEBI:9699) has role antifungal agent (CHEBI:35718) tridec-1-ene-3,5,7,9,11-pentayne (CHEBI:9699) has role nematicide (CHEBI:25491) tridec-1-ene-3,5,7,9,11-pentayne (CHEBI:9699) has role ovicide (CHEBI:167523) tridec-1-ene-3,5,7,9,11-pentayne (CHEBI:9699) has role plant metabolite (CHEBI:76924) tridec-1-ene-3,5,7,9,11-pentayne (CHEBI:9699) has role volatile oil component (CHEBI:27311) tridec-1-ene-3,5,7,9,11-pentayne (CHEBI:9699) is a acyclic acetylene (CHEBI:33650) tridec-1-ene-3,5,7,9,11-pentayne (CHEBI:9699) is a acyclic olefin (CHEBI:33645) tridec-1-ene-3,5,7,9,11-pentayne (CHEBI:9699) is a enyne (CHEBI:59831) tridec-1-ene-3,5,7,9,11-pentayne (CHEBI:9699) is a pentayne (CHEBI:167522)

IUPAC Name

tridec-1-ene-3,5,7,9,11-pentayne

Registry Number	Type	Source
2060-59-5	CAS Registry Number	ChemIDplus

Last Modified

19 February 2021