EMBL-EBI | Chemical Biology Resources | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:760745 - 1-(7-hexadecanoyloxy-octadecanoyl)-2,3-di-(9Z,12Z-octadecadienoyl)-sn-glycerol

Default Structure
ChEBI IDCHEBI:760745
ChEBI Name1-(7-hexadecanoyloxy-octadecanoyl)-2,3-di-(9Z,12Z-octadecadienoyl)-sn-glycerol
Stars
DefinitionA triglyceride estolide in which the acyl group at positions 1 is specified as 7-PAHSA (7-hexadecanoyloxy-octadecanoyl), while those at positions 2 and 3 are both linoleoyl (9Z,12Z-octadecadienoyl) groups.
Last Modified9 September 2026
Submitternhn
DownloadsMolfile
FormulaC73H132O8
Net Charge0
Average Mass1137.851
Monoisotopic Mass1136.99222
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCC(CCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC
InChIInChI=1S/C73H132O8/c1-5-9-13-17-21-25-28-31-33-36-38-42-46-50-56-62-70(74)78-66-69(81-73(77)65-58-52-48-44-40-37-34-32-29-26-22-18-14-10-6-2)67-79-71(75)63-59-53-55-61-68(60-54-49-45-41-24-20-16-12-8-4)80-72(76)64-57-51-47-43-39-35-30-27-23-19-15-11-7-3/h21-22,25-26,31-34,68-69H,5-20,23-24,27-30,35-67H2,1-4H3/b25-21-,26-22-,33-31-,34-32-/t68?,69-/m0/s1
InChIKeyYPOGANPQJSZEGT-YNAGDOBHSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(7-hexadecanoyloxy-octadecanoyl)-2,3-di-(9Z,12Z-octadecadienoyl)-sn-glycerol (CHEBI:760745) is a triglyceride estolide (CHEBI:760738)
Synonyms  Source
1-(7-(palmitoyloxy)stearoyl)-2,3-dilinoleoyl-sn-glycerolSUBMITTER
TG 16:0-(7-O-16:0)/18:2(9Z,12Z)/18:2(9Z,12Z)SUBMITTER
TG-EST 7-PAHSA/18:2/18:2SUBMITTER
UniProt Name  Source
1-(7-hexadecanoyloxy-octadecanoyl)-2,3-di-(9Z,12Z-octadecadienoyl)-sn-glycerolUniProt
Citations