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CHEBI:760852 - 2-(9Z,12Z-octadecadienoyl)-3-(5-hexadecanoyloxy-octadecanoyl)-sn-glycerol

Default Structure
ChEBI IDCHEBI:760852
ChEBI Name2-(9Z,12Z-octadecadienoyl)-3-(5-hexadecanoyloxy-octadecanoyl)-sn-glycerol
Stars
DefinitionA diglyceride estolide in which the acyl groups at positions 2 and 3 are specified as linoleoyl (9Z,12Z-octadecadienoyl) and 5-PAHSA (5-hexadecanoyloxy-octadecanoyl) respectively.
Last Modified9 September 2026
Submitternhn
DownloadsMolfile
FormulaC55H102O7
Net Charge0
Average Mass875.414
Monoisotopic Mass874.76256
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](CO)COC(=O)CCCC(CCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC
InChIInChI=1S/C55H102O7/c1-4-7-10-13-16-19-22-24-25-27-30-33-36-39-42-47-55(59)62-52(49-56)50-60-53(57)48-43-45-51(44-40-37-34-31-28-21-18-15-12-9-6-3)61-54(58)46-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h16,19,24-25,51-52,56H,4-15,17-18,20-23,26-50H2,1-3H3/b19-16-,25-24-/t51?,52-/m1/s1
InChIKeyDULGLVVOJBZSJZ-OVDGRSEZSA-N
ChEBI Ontology
Outgoing Relation(s)
2-(9Z,12Z-octadecadienoyl)-3-(5-hexadecanoyloxy-octadecanoyl)-sn-glycerol (CHEBI:760852) is a diglyceride estolide (CHEBI:760752)
Synonym  Source
DG-EST 0:0/18:2(9Z,12Z)/5-PAHSASUBMITTER
UniProt Name  Source
2-(9Z,12Z-octadecadienoyl)-3-(5-hexadecanoyloxy-octadecanoyl)-sn-glycerolUniProt
Citations