CHEBI:76979 - 1,2-dioctanoyl-sn-glycerol

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ChEBI Name 1,2-dioctanoyl-sn-glycerol
ChEBI ID CHEBI:76979
ChEBI ASCII Name 1,2-dioctanoyl-sn-glycerol
Definition 1,2-diacyl-sn-glycerol in which both the 1- and 2-acyl groups are specified as octanoyl. Formula C19H36O5.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Lucila Aimo
Supplier Information
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Formula C19H36O5
Net Charge 0
Average Mass 344.48610
Monoisotopic Mass 344.25627
InChI InChI=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-/m0/s1
InChIKey ZQBULZYTDGUSSK-KRWDZBQOSA-N
SMILES CCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCC
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
(via diglyceride )
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
(via diglyceride )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1,2-dioctanoyl-sn-glycerol (CHEBI:76979) is a 1,2-diacyl-sn-glycerol (CHEBI:17815)
1,2-dioctanoyl-sn-glycerol (CHEBI:76979) is a dioctanoylglycerol (CHEBI:88066)
1,2-dioctanoyl-sn-glycerol (CHEBI:76979) is enantiomer of 2,3-dioctanoyl-sn-glycerol (CHEBI:76982)
Incoming 2,3-dioctanoyl-sn-glycerol (CHEBI:76982) is enantiomer of 1,2-dioctanoyl-sn-glycerol (CHEBI:76979)
IUPAC Name
(2S)-3-hydroxypropane-1,2-diyl dioctanoate
Synonyms Sources
1,2-dicapryloyl-sn-glycerol ChEBI
1,2-dioctanoyl-sn-glycerol UniProt
1,2-dioctanoylglycerol MetaCyc
1,2-octanoyl-sn-diglyceride SUBMITTER
D-α,β-dicaprylin MetaCyc
DG(8:0/8:0/0:0) ChEBI
dicaprylglyceride MetaCyc
octanoic acid, 1-(hydroxymethyl)-1,2-ethanediyl ester MetaCyc
sn-1,2-dicaprilin ChEBI
sn-1,2-Dioctanoylglycerol ChemIDplus
Manual Xref Database
CPD-13470 MetaCyc
View more database links
Registry Numbers Types Sources
1714754 Reaxys Registry Number Reaxys
1714754 Beilstein Registry Number ChemIDplus
60514-48-9 CAS Registry Number ChemIDplus
Last Modified
19 August 2019