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5-[(9Z)-octadecenoyloxy]octadecanoate

Go to external page http://purl.obolibrary.org/obo/CHEBI_136389

A monocarboxylic acid anion that is the conjugate base of 5-[(9Z)-octadecenoyloxy]octadecanoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.

Term info

Label

5-[(9Z)-octadecenoyloxy]octadecanoate

Synonyms
  • 5-{[(9Z)-octadec-9-enoyl]oxy}octadecanoate
database cross reference
Subsets

3_STAR

IUPAC NAME
5-{[(9Z)-octadec-9-enoyl]oxy}octadecanoate [ IUPAC ]

charge

-1

formula

C36H67O4

has obo namespace

chebi_ontology

has related synonym

oleoyl-5-hydroxystearate ester(1-), 5-OAHSA(1-), 5-(oleoyloxy)stearate, 5-(9Z-octadecenoyloxy)-octadecanoate, FAHFA(18:1(9Z)/5-O-18:0)(1-)

id

CHEBI:136389

inchi

InChI=1S/C36H68O4/c1-3-5-7-9-11-13-15-16-17-18-20-22-24-26-28-33-36(39)40-34(31-29-32-35(37)38)30-27-25-23-21-19-14-12-10-8-6-4-2/h16-17,34H,3-15,18-33H2,1-2H3,(H,37,38)/p-1/b17-16-

inchikey

FQZBGGYKEFIGPO-MSUUIHNZSA-M

mass

563.916

monoisotopicmass

563.50448

smiles

C(CCCC(CCCC(=O)[O-])OC(CCCCCCC/C=C\CCCCCCCC)=O)CCCCCCCCC