CHEBI:190960 - 1-palmitoyl-2-oleoyl-3-linoleoyl-rac-glycerol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 1-palmitoyl-2-oleoyl-3-linoleoyl-rac-glycerol
ChEBI ID CHEBI:190960
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C55H100O6
Net Charge 0
Average Mass 857.399
Monoisotopic Mass 856.75199
InChI InChI=1S/C55H100O6/c1-4-7-10-13-16-19-22-25-27-30-33-36-39-42-45-48-54(57)60-51-52(50-59-53(56)47-44-41-38-35-32-29-24-21-18-15-12-9-6-3)61-55(58)49-46-43-40-37-34-31-28-26-23-20-17-14-11-8-5-2/h16,19,25-28,52H,4-15,17-18,20-24,29-51H2,1-3H3/b19-16-,27-25-,28-26-
InChIKey KGLAHZTWGPHKFF-FBSASISJSA-N
SMILES O(C(=O)CCCCCCCCCCCCCCC)CC(OC(=O)CCCCCCC/C=C\CCCCCCCC)COC(=O)CCCCCCC/C=C\C/C=C\CCCCC
Metabolite of Species Details
Rattus norvegicus (NCBI:txid10116) Found in INS-1 cell (BTO:0002135). See: MetaboLights Study
ChEBI Ontology
Outgoing 1-palmitoyl-2-oleoyl-3-linoleoyl-rac-glycerol (CHEBI:190960) is a triglyceride (CHEBI:17855)
IUPAC Name
[1-hexadecanoyloxy-3-[(9Z,12Z)-octadeca-9,12-dienoyl]oxypropan-2-yl] (Z)-octadec-9-enoate
Manual Xrefs Databases
21171652 ChemSpider
LMGL03010121 LIPID MAPS
View more database links
Registry Number Type Source
2680-59-3 CAS Registry Number ChemIDplus