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CHEBI:76982 - 2,3-dioctanoyl-sn-glycerol

ChEBI IDCHEBI:76982
ChEBI Name2,3-dioctanoyl-sn-glycerol
Stars
ASCII Name2,3-dioctanoyl-sn-glycerol
DefinitionA 2,3-diacyl-sn-glycerol in which both the 2- and 3-acyl groups are specified as octanoyl.
Last Modified18 January 2019
Submitterlaimo
DownloadsMolfile
FormulaC19H36O5
Net Charge0
Average Mass344.492
Monoisotopic Mass344.25627
SMILES[H][C@@](CO)(COC(=O)CCCCCCC)OC(=O)CCCCCCC
InChIInChI=1S/C19H36O5/c1-3-5-7-9-11-13-18(21)23-16-17(15-20)24-19(22)14-12-10-8-6-4-2/h17,20H,3-16H2,1-2H3/t17-/m1/s1
InChIKeyZQBULZYTDGUSSK-QGZVFWFLSA-N
Roles Classification
Biological Roles:
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
2,3-dioctanoyl-sn-glycerol (CHEBI:76982) is a 2,3-diacyl-sn-glycerol (CHEBI:75524)
2,3-dioctanoyl-sn-glycerol (CHEBI:76982) is a dioctanoylglycerol (CHEBI:88066)
2,3-dioctanoyl-sn-glycerol (CHEBI:76982) is enantiomer of 1,2-dioctanoyl-sn-glycerol (CHEBI:76979)
Incoming Relation(s)
1,2-dioctanoyl-sn-glycerol (CHEBI:76979) is enantiomer of 2,3-dioctanoyl-sn-glycerol (CHEBI:76982)
IUPAC Name 
(2R)-3-hydroxypropane-1,2-diyl dioctanoate
Synonyms  Source
sn-2,3-octanoyl-diglycerideSUBMITTER
sn-2,3-dioctanoinChEBI
sn-2,3-dioctanoylglycerolChEBI
sn-2,3-dicapryloylglycerolChEBI
2,3-dicapryloyl-sn-glycerolChEBI
sn-2,3-dicaprilinChEBI
UniProt Name  Source
2,3-dioctanoyl-sn-glycerolUniProt
Registry NumbersSources
Reaxys:7858077Reaxys