CHEBI:136315 - 13-[(9Z)-hexadecenoyloxy]octadecanoate

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ChEBI Name 13-[(9Z)-hexadecenoyloxy]octadecanoate
ChEBI ID CHEBI:136315
ChEBI ASCII Name 13-[(9Z)-hexadecenoyloxy]octadecanoate
Definition A mnocarboxylic acid anion that is the conjugate base of 13-[(9Z)-hexadecenoyloxy]octadecanoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Nevila Nouspikel
Supplier Information
Download Molfile XML SDF
Formula C34H63O4
Net Charge -1
Average Mass 535.863
Monoisotopic Mass 535.47318
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)/p-1/b11-10-
InChIKey FHXCZZFHUCAQAA-KHPPLWFESA-M
SMILES C(\CCCCCCCC(=O)OC(CCCCCCCCCCCC(=O)[O-])CCCCC)=C\CCCCCC
ChEBI Ontology
Outgoing 13-[(9Z)-hexadecenoyloxy]octadecanoate (CHEBI:136315) is a monocarboxylic acid anion (CHEBI:35757)
13-[(9Z)-hexadecenoyloxy]octadecanoate (CHEBI:136315) is conjugate base of 13-[(9Z)-hexadecenoyloxy]octadecanoic acid (CHEBI:137086)
Incoming 13-[(9Z)-hexadecenoyloxy]octadecanoic acid (CHEBI:137086) is conjugate acid of 13-[(9Z)-hexadecenoyloxy]octadecanoate (CHEBI:136315)
IUPAC Name
13-{[(9Z)-hexadec-9-enoyl]oxy}octadecanoate
Synonyms Sources
13-(9Z-hexadecenoyloxy)-octadecanoate UniProt
13-POHSA(1−) ChEBI
FAHFA(16:1(9Z)/13-O-18:0)(1−) SUBMITTER
Citation Waiting for Citations Type Source
27509211 PubMed citation SUBMITTER
Last Modified
19 May 2017