CHEBI:86136 - (5Z,9Z,12Z)-octadecatrienoic acid

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ChEBI Name (5Z,9Z,12Z)-octadecatrienoic acid
ChEBI ID CHEBI:86136
ChEBI ASCII Name (5Z,9Z,12Z)-octadecatrienoic acid
Definition An octadecatrienoic acid having three double bonds located at positions 5, 9 and 12 (the all-cis-isomer).
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C18H30O2
Net Charge 0
Average Mass 278.42960
Monoisotopic Mass 278.225
InChI InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,13-14H,2-5,8,11-12,15-17H2,1H3,(H,19,20)/b7-6-,10-9-,14-13-
InChIKey HXQHFNIKBKZGRP-URPRIDOGSA-N
SMILES CCCCC\C=C/C\C=C/CC\C=C/CCCC(O)=O
Metabolite of Species Details
Pinus koraiensis (NCBI:txid88728) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (5Z,9Z,12Z)-octadecatrienoic acid (CHEBI:86136) has role antineoplastic agent (CHEBI:35610)
(5Z,9Z,12Z)-octadecatrienoic acid (CHEBI:86136) has role plant metabolite (CHEBI:76924)
(5Z,9Z,12Z)-octadecatrienoic acid (CHEBI:86136) is a octadecatrienoic acid (CHEBI:25633)
Incoming (5Z,9Z,12Z)-octadecatrienoyl-containing glycerolipid (CHEBI:88238) has functional parent (5Z,9Z,12Z)-octadecatrienoic acid (CHEBI:86136)
(5Z,9Z,12Z)-octadecatrienoyl group (CHEBI:85916) is substituent group from (5Z,9Z,12Z)-octadecatrienoic acid (CHEBI:86136)
IUPAC Name
(5Z,9Z,12Z)-octadeca-5,9,12-trienoic acid
Synonyms Sources
5Z,9Z,12Z-octadecatrienoic acid LIPID MAPS
all-cis-octadeca-5,9,12-trienoic acid ChEBI
C18:3n-6,9,13 LIPID MAPS
cis,cis,cis-5,9,12-Octadecatrienoic acid ChemIDplus
Pinolenic acid LIPID MAPS
Manual Xrefs Databases
CPD-14869 MetaCyc
LMFA01030344 LIPID MAPS
Pinolenic_acid Wikipedia
View more database links
Registry Numbers Types Sources
16833-54-8 CAS Registry Number ChemIDplus
1912698 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
21953622 PubMed citation Europe PMC
22309126 PubMed citation Europe PMC
22753389 PubMed citation Europe PMC
23988007 PubMed citation Europe PMC
25213948 PubMed citation Europe PMC
25306361 PubMed citation Europe PMC
25916176 PubMed citation Europe PMC
Last Modified
22 June 2015