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CHEBI:184345 - (2R)-2-(Icosanoyloxy)-3-(octadecyloxy)propyl (11Z,14Z)-icosa-11,14-dienoate

ChEBI IDCHEBI:184345
ChEBI Name(2R)-2-(Icosanoyloxy)-3-(octadecyloxy)propyl (11Z,14Z)-icosa-11,14-dienoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC61H116O5
Net Charge0
Average Mass929.594
Monoisotopic Mass928.88228
SMILESCCCCC/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@@H](COCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C61H116O5/c1-4-7-10-13-16-19-22-25-28-31-33-36-39-42-45-48-51-54-60(62)65-58-59(57-64-56-53-50-47-44-41-38-35-30-27-24-21-18-15-12-9-6-3)66-61(63)55-52-49-46-43-40-37-34-32-29-26-23-20-17-14-11-8-5-2/h16,19,25,28,59H,4-15,17-18,20-24,26-27,29-58H2,1-3H3/b19-16-,28-25-/t59-/m1/s1
InChIKeyREPZHTARFKJLGK-UWVPRLFQSA-N
Species of MetaboliteComponentSourceComments
Bos taurus (ncbitaxon:9913)
spermatozoon (FMA:67338) MetaboLights (MTBLS1071) Strain: Holstein-Friesian cattle [26105007]
spermatozoon (BTO:0001277) MetaboLights (MTBLS1071) Strain: Holstein-Friesian cattle [26105007]
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)
(2R)-2-(Icosanoyloxy)-3-(octadecyloxy)propyl (11Z,14Z)-icosa-11,14-dienoate (CHEBI:184345) is a diglyceride (CHEBI:18035)
IUPAC Name 
[(2R)-1-[(11Z,14Z)-icosa-11,14-dienoyl]oxy-3-octadecoxypropan-2-yl] icosanoate
Manual XrefsDatabases
HMDB0053328HMDB
59662050ChemSpider