CHEBI:137086 - 13-[(9Z)-hexadecenoyloxy]octadecanoic acid

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ChEBI Name 13-[(9Z)-hexadecenoyloxy]octadecanoic acid
ChEBI ID CHEBI:137086
ChEBI ASCII Name 13-[(9Z)-hexadecenoyloxy]octadecanoic acid
Definition A fatty acid ester obtained by formal condensation of the carboxy group of (9Z)-hexadecenoic acid with the hydroxy group of 13-hydroxyoctadecanoic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C34H64O4
Net Charge 0
Average Mass 536.871
Monoisotopic Mass 536.48046
InChI InChI=1S/C34H64O4/c1-3-5-7-8-9-10-11-12-13-17-20-23-27-31-34(37)38-32(28-24-6-4-2)29-25-21-18-15-14-16-19-22-26-30-33(35)36/h10-11,32H,3-9,12-31H2,1-2H3,(H,35,36)/b11-10-
InChIKey FHXCZZFHUCAQAA-KHPPLWFESA-N
SMILES C(\CCCCCCCC(=O)OC(CCCCCCCCCCCC(=O)O)CCCCC)=C\CCCCCC
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 13-[(9Z)-hexadecenoyloxy]octadecanoic acid (CHEBI:137086) has functional parent 13-hydroxyoctadecanoic acid (CHEBI:136406)
13-[(9Z)-hexadecenoyloxy]octadecanoic acid (CHEBI:137086) has functional parent palmitoleic acid (CHEBI:28716)
13-[(9Z)-hexadecenoyloxy]octadecanoic acid (CHEBI:137086) is a fatty acid ester (CHEBI:35748)
13-[(9Z)-hexadecenoyloxy]octadecanoic acid (CHEBI:137086) is a monocarboxylic acid (CHEBI:25384)
13-[(9Z)-hexadecenoyloxy]octadecanoic acid (CHEBI:137086) is conjugate acid of 13-[(9Z)-hexadecenoyloxy]octadecanoate (CHEBI:136315)
Incoming 13-[(9Z)-hexadecenoyloxy]octadecanoate (CHEBI:136315) is conjugate base of 13-[(9Z)-hexadecenoyloxy]octadecanoic acid (CHEBI:137086)
IUPAC Name
13-{[(9Z)-hexadec-9-enoyl]oxy}octadecanoic acid
Synonyms Sources
13-(9Z-hexadecenoyloxy)-octadecanoic acid LIPID MAPS
13-(palmitoleoyloxy)stearic acid ChEBI
13-POHSA LIPID MAPS
FAHFA(16:1(9Z)/13-O-18:0) LIPID MAPS
Manual Xref Database
LMFA07011057 LIPID MAPS
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Citation Waiting for Citations Type Source
27509211 PubMed citation Europe PMC
Last Modified
19 May 2017