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CHEBI:185560 - 3-(Icosanoyloxy)-2-(octadecyloxy)propyl icosanoate

ChEBI IDCHEBI:185560
ChEBI Name3-(Icosanoyloxy)-2-(octadecyloxy)propyl icosanoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC61H120O5
Net Charge0
Average Mass933.626
Monoisotopic Mass932.91358
SMILESCCCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C61H120O5/c1-4-7-10-13-16-19-22-25-28-31-33-36-39-42-45-48-51-54-60(62)65-57-59(64-56-53-50-47-44-41-38-35-30-27-24-21-18-15-12-9-6-3)58-66-61(63)55-52-49-46-43-40-37-34-32-29-26-23-20-17-14-11-8-5-2/h59H,4-58H2,1-3H3
InChIKeyFMJYQRZHDXWKIL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bos taurus (ncbitaxon:9913) spermatozoon (BTO:0001277) MetaboLights (MTBLS1071) Strain: Holstein [LBO:0000132]
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
ChEBI Ontology
Outgoing Relation(s)
3-(Icosanoyloxy)-2-(octadecyloxy)propyl icosanoate (CHEBI:185560) is a diglyceride (CHEBI:18035)
IUPAC Name 
(3-icosanoyloxy-2-octadecoxypropyl) icosanoate
Manual XrefsDatabases
30777788ChemSpider
HMDB0046231HMDB