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CHEBI:75688 - 1,3-dipalmitoyl-2-oleoylglycerol

ChEBI IDCHEBI:75688
ChEBI Name1,3-dipalmitoyl-2-oleoylglycerol
Stars
DefinitionA triglyceride in which the 1- and 3-acyl groups are palmitoyl while that at position 2 is oleoyl.
Last Modified31 August 2017
Submitterlaimo
DownloadsMolfile
FormulaC53H100O6
Net Charge0
Average Mass833.377
Monoisotopic Mass832.75199
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC
InChIInChI=1S/C53H100O6/c1-4-7-10-13-16-19-22-25-26-29-32-35-38-41-44-47-53(56)59-50(48-57-51(54)45-42-39-36-33-30-27-23-20-17-14-11-8-5-2)49-58-52(55)46-43-40-37-34-31-28-24-21-18-15-12-9-6-3/h25-26,50H,4-24,27-49H2,1-3H3/b26-25-
InChIKeyFDCOHGHEADZEGF-QPLCGJKRSA-N
ChEBI Ontology
Outgoing Relation(s)
1,3-dipalmitoyl-2-oleoylglycerol (CHEBI:75688) has functional parent hexadecanoic acid (CHEBI:15756)
1,3-dipalmitoyl-2-oleoylglycerol (CHEBI:75688) has functional parent oleic acid (CHEBI:16196)
1,3-dipalmitoyl-2-oleoylglycerol (CHEBI:75688) is a triacylglycerol 50:1 (CHEBI:84665)
IUPAC Name 
1,3-bis(hexadecanoyloxy)propan-2-yl (9Z)-octadec-9-enoate
Synonyms  Source
TG(16:0/18:1(ω-9)/16:0)SUBMITTER
1-Hexadecanoyl-2-(9Z-octadecenoyl)-3-hexadecanoyl-glycerolHMDB
Triacylglycerol(50:1)HMDB
TG(50:1)HMDB
1-Palmitoyl-2-oleoyl-3-palmitoyl-glycerolHMDB
TAG(16:0/18:1/16:0)HMDB
UniProt Name  Source
1,3-dihexadecanoyl-2-(9Z-octadecenoyl)glycerolUniProt
Registry NumbersSources
Reaxys:1730673Reaxys