CHEBI:32428 - cetoleic acid

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ChEBI Name cetoleic acid
ChEBI ID CHEBI:32428
Definition A docosenoic acid having a cis-double bond at position 11.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C22H42O2
Net Charge 0
Average Mass 338.56770
Monoisotopic Mass 338.318
InChI InChI=1S/C22H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h11-12H,2-10,13-21H2,1H3,(H,23,24)/b12-11-
InChIKey KJDZDTDNIULJBE-QXMHVHEDSA-N
SMILES CCCCCCCCCC\C=C/CCCCCCCCCC(O)=O
Metabolite of Species Details
Daphnia tenebrosa (NCBI:txid521141) See: Trophic transfer and trophic modification of fatty acids in high Arctic lakesHessen D., Liu E.Freshwater Biology (2006) 51, 1987-1998
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): Daphnia tenebrosa metabolite
A Daphnia metabolite produced by the species Daphnia tenebrosa.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing cetoleic acid (CHEBI:32428) has role Daphnia tenebrosa metabolite (CHEBI:83146)
cetoleic acid (CHEBI:32428) is a docosenoic acid (CHEBI:36031)
cetoleic acid (CHEBI:32428) is conjugate acid of cetoleate (CHEBI:32429)
Incoming 1-icosyl-2-[(11Z)-docosenoyl]-sn-glycero-3-phosphocholine (CHEBI:86449) has functional parent cetoleic acid (CHEBI:32428)
1-octadecyl-2-[(11Z)-docosenoyl]-sn-glycero-3-phosphocholine (CHEBI:86443) has functional parent cetoleic acid (CHEBI:32428)
ethyl (11Z)-docosenoate (CHEBI:84888) has functional parent cetoleic acid (CHEBI:32428)
cetoleate (CHEBI:32429) is conjugate base of cetoleic acid (CHEBI:32428)
cetoleoyl group (CHEBI:32430) is substituent group from cetoleic acid (CHEBI:32428)
IUPAC Name
(11Z)-docos-11-enoic acid
Synonyms Sources
(Z)-11-docosenoic acid ChemIDplus
(Z)-docos-11-enoic acid ChEBI
22:1, n-11 cis ChEBI
C22:1, n-11 cis ChEBI
Cetoleinsäure ChEBI
cis-11-docosenoic acid ChEBI
cis11-docosenoic acid ChEBI
cis-docos-11-enoic acid ChEBI
docos-11c-enoic acid ChEBI
Docos-11c-ensäure ChEBI
Manual Xrefs Databases
HMDB0002884 HMDB
LMFA01030088 LIPID MAPS
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Registry Numbers Types Sources
1002-96-6 CAS Registry Number ChemIDplus
1728046 Beilstein Registry Number Beilstein
1728046 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
14282926 PubMed citation Europe PMC
16826508 PubMed citation Europe PMC
410406 PubMed citation Europe PMC
Last Modified
13 July 2015