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13-(octadecanoyloxy)octadecanoic acid

Go to external page http://purl.obolibrary.org/obo/CHEBI_137091

A fatty acid ester obtained by formal condensation of the carboxy group of octadecanoic acid with the hydroxy group of 13-hydroxyoctadecanoic acid.

Term info

Label

13-(octadecanoyloxy)octadecanoic acid

Synonyms
  • 13-(octadecanoyloxy)octadecanoic acid
database cross reference
Subsets

3_STAR

IUPAC NAME
13-(octadecanoyloxy)octadecanoic acid [ IUPAC ]

charge

0

formula

C36H70O4

has obo namespace

chebi_ontology

has related synonym

13-octadecanoyloxy-octadecanoic acid, FAHFA(18:0/13-O-18:0), 13-SAHSA, 13-(stearoyloxy)stearic acid

id

CHEBI:137091

inchi

InChI=1S/C36H70O4/c1-3-5-7-8-9-10-11-12-13-14-15-19-22-25-29-33-36(39)40-34(30-26-6-4-2)31-27-23-20-17-16-18-21-24-28-32-35(37)38/h34H,3-33H2,1-2H3,(H,37,38)

inchikey

OCKHONDLGBRMHC-UHFFFAOYSA-N

mass

566.940

monoisotopicmass

566.52741

smiles

C(CCCCCCCC(=O)OC(CCCCCCCCCCCC(=O)O)CCCCC)CCCCCCCCC