EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:131508 - 1,2-dihexanoyl-sn-glycero-3-phosphate

ChEBI IDCHEBI:131508
ChEBI Name1,2-dihexanoyl-sn-glycero-3-phosphate
Stars
ASCII Name1,2-dihexanoyl-sn-glycero-3-phosphate
DefinitionA 1,2-diacyl-sn-glycero-3-phosphate in which the acyl groups at positions 1 and 2 are specified as hexanoyl.
Last Modified10 March 2016
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC15H29O8P
Net Charge0
Average Mass368.363
Monoisotopic Mass368.16000
SMILESCCCCCC(=O)OC[C@H](COP(=O)(O)O)OC(=O)CCCCC
InChIInChI=1S/C15H29O8P/c1-3-5-7-9-14(16)21-11-13(12-22-24(18,19)20)23-15(17)10-8-6-4-2/h13H,3-12H2,1-2H3,(H2,18,19,20)/t13-/m1/s1
InChIKeySFZZRGHNPILUOD-CYBMUJFWSA-N
Roles Classification
Biological Role:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
1,2-dihexanoyl-sn-glycero-3-phosphate (CHEBI:131508) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
1,2-dihexanoyl-sn-glycero-3-phosphate (CHEBI:131508) is a hexanoate ester (CHEBI:87656)
IUPAC Name 
(2R)-3-(phosphonooxy)propane-1,2-diyl dihexanoate
Synonyms  Source
1,2-dihexanoyl-sn-glycero-3-phosphatidic acidChEBI
PA(6:0/6:0)LIPID MAPS
1,2-dicaproyl-sn-glycero-3-phosphateLIPID MAPS
hexanoic acid, (R)-1-[(phosphonooxy)methyl]-1,2-ethanediyl esterLIPID MAPS
PA(12:0)ChEBI
06:0 PAChEBI
Manual XrefsDatabases
44EPDBeChem
LMGP10010020LIPID MAPS
Citations