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CHEBI:132775 - 1-oleoyl-2-isoheptadecanoyl-3-pentadecanoyl-sn-glycerol

ChEBI IDCHEBI:132775
ChEBI Name1-oleoyl-2-isoheptadecanoyl-3-pentadecanoyl-sn-glycerol
Stars
ASCII Name1-oleoyl-2-isoheptadecanoyl-3-pentadecanoyl-sn-glycerol
DefinitionA triacylglycerol 50:1 in which the acyl groups at positions 1, 2 and 3 are specified as oleoyl, isoheptadecanoyl and pentadecanoyl respectively. It is a metabolite of the nematode Caenorhabditis elegans.
Last Modified21 July 2016
SubmitterSteve
DownloadsMolfile
FormulaC53H100O6
Net Charge0
Average Mass833.377
Monoisotopic Mass832.75199
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCC(C)C
InChIInChI=1S/C53H100O6/c1-5-7-9-11-13-15-17-19-20-21-25-29-33-37-41-45-52(55)58-48-50(47-57-51(54)44-40-36-32-28-24-18-16-14-12-10-8-6-2)59-53(56)46-42-38-34-30-26-22-23-27-31-35-39-43-49(3)4/h19-20,49-50H,5-18,21-48H2,1-4H3/b20-19-/t50-/m0/s1
InChIKeyOUHLKPMNPWFJMR-VAODPLLESA-N
Species of MetaboliteComponentSourceComments
Caenorhabditis elegans (ncbitaxon:6239) - PubMed (23475189)
Roles Classification
Biological Role:
Caenorhabditis elegans metabolite  A nematode metabolite produced by Caenorhabditis elegans.
ChEBI Ontology
Outgoing Relation(s)
1-oleoyl-2-isoheptadecanoyl-3-pentadecanoyl-sn-glycerol (CHEBI:132775) has role Caenorhabditis elegans metabolite (CHEBI:78804)
1-oleoyl-2-isoheptadecanoyl-3-pentadecanoyl-sn-glycerol (CHEBI:132775) is a triacyl-sn-glycerol (CHEBI:64615)
1-oleoyl-2-isoheptadecanoyl-3-pentadecanoyl-sn-glycerol (CHEBI:132775) is a triacylglycerol 50:1 (CHEBI:84665)
IUPAC Name 
(2R)-[(15-methylhexadecanoyl)oxy]-3-(pentadecanoyloxy)propyl (9Z)-octadec-9-enoate
Synonyms  Source
TAG(18:1/17:0Δ/15:0)ChEBI
1-[(9Z)-octadecenoyl]-2-(15-methylhexadecanoyl)-3-pentadecanoyl-sn-glycerolChEBI
TG(18:1/17:0Δ/15:0)ChEBI
Citations