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CHEBI:140526 - 1,2-dihexanoyl-sn-glycerol

ChEBI IDCHEBI:140526
ChEBI Name1,2-dihexanoyl-sn-glycerol
Stars
ASCII Name1,2-dihexanoyl-sn-glycerol
DefinitionA 1,2-diacyl-sn-glycerol in which both acyl groups are specified as hexanoyl.
Last Modified23 April 2018
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC15H28O5
Net Charge0
Average Mass288.384
Monoisotopic Mass288.19367
SMILESCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCC
InChIInChI=1S/C15H28O5/c1-3-5-7-9-14(17)19-12-13(11-16)20-15(18)10-8-6-4-2/h13,16H,3-12H2,1-2H3/t13-/m0/s1
InChIKeyDRUFTGMQJWWIOL-ZDUSSCGKSA-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)
1,2-dihexanoyl-sn-glycerol (CHEBI:140526) has functional parent hexanoic acid (CHEBI:30776)
1,2-dihexanoyl-sn-glycerol (CHEBI:140526) is a 1,2-diacyl-sn-glycerol (CHEBI:17815)
1,2-dihexanoyl-sn-glycerol (CHEBI:140526) is a 1,2-dihexanoylglycerol (CHEBI:177077)
IUPAC Name 
(2S)-3-hydroxypropane-1,2-diyl dihexanoate
Synonyms  Source
(2S)-1,2-dihexanoylglycerolChEBI
(S)-1,2-dihexanoylglycerolChEBI
1,2-dicaproyl-sn-glycerolChEBI
UniProt Name  Source
1,2-dihexanoyl-sn-glycerolUniProt
Registry NumbersSources
Reaxys:1713329Reaxys
Citations