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CHEBI:136389 - 5-[(9Z)-octadecenoyloxy]octadecanoate

ChEBI IDCHEBI:136389
ChEBI Name5-[(9Z)-octadecenoyloxy]octadecanoate
Stars
ASCII Name5-[(9Z)-octadecenoyloxy]octadecanoate
DefinitionA 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.
Last Modified19 May 2017
Submitternhn
DownloadsMolfile
FormulaC36H67O4
Net Charge-1
Average Mass563.928
Monoisotopic Mass563.50448
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)OC(CCCCCCCCCCCCC)CCCC(=O)[O-]
InChIInChI=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-
InChIKeyFQZBGGYKEFIGPO-MSUUIHNZSA-M
ChEBI Ontology
Outgoing Relation(s)
5-[(9Z)-octadecenoyloxy]octadecanoate (CHEBI:136389) is a monocarboxylic acid anion (CHEBI:35757)
5-[(9Z)-octadecenoyloxy]octadecanoate (CHEBI:136389) is conjugate base of 5-[(9Z)-octadecenoyloxy]octadecanoic acid (CHEBI:137106)
Incoming Relation(s)
5-[(9Z)-octadecenoyloxy]octadecanoic acid (CHEBI:137106) is conjugate acid of 5-[(9Z)-octadecenoyloxy]octadecanoate (CHEBI:136389)
IUPAC Name 
5-{[(9Z)-octadec-9-enoyl]oxy}octadecanoate
Synonyms  Source
oleoyl-5-hydroxystearate ester(1−)SUBMITTER
FAHFA(18:1(9Z)/5-O-18:0)(1−)SUBMITTER
5-OAHSA(1−)ChEBI
5-(oleoyloxy)stearateChEBI
UniProt Name  Source
5-(9Z-octadecenoyloxy)-octadecanoateUniProt
Citations