CHEBI:79074 - 1,2-dicapryl-sn-glycero-3-phosphate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1,2-dicapryl-sn-glycero-3-phosphate
ChEBI ID CHEBI:79074
ChEBI ASCII Name 1,2-dicapryl-sn-glycero-3-phosphate
Definition A 1,2-diacyl-sn-glycero-3-phosphate in which the acyl groups at positions 1 and 2 are specified as capryl (decanoyl).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C23H45O8P
Net Charge 0
Average Mass 480.57240
Monoisotopic Mass 480.28521
InChI InChI=1S/C23H45O8P/c1-3-5-7-9-11-13-15-17-22(24)29-19-21(20-30-32(26,27)28)31-23(25)18-16-14-12-10-8-6-4-2/h21H,3-20H2,1-2H3,(H2,26,27,28)/t21-/m1/s1
InChIKey PHQFPHNJHDEXLJ-OAQYLSRUSA-N
SMILES CCCCCCCCCC(=O)OC[C@H](COP(O)(O)=O)OC(=O)CCCCCCCCC
Roles Classification
Biological Role(s): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
(via phosphatidic acid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1,2-dicapryl-sn-glycero-3-phosphate (CHEBI:79074) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
1,2-dicapryl-sn-glycero-3-phosphate (CHEBI:79074) is a decanoate ester (CHEBI:87658)
1,2-dicapryl-sn-glycero-3-phosphate (CHEBI:79074) is conjugate acid of 1,2-dicapryl-sn-glycero-3-phosphate(2−) (CHEBI:78227)
Incoming 1,2-dicapryl-sn-glycero-3-phosphate(2−) (CHEBI:78227) is conjugate base of 1,2-dicapryl-sn-glycero-3-phosphate (CHEBI:79074)
IUPAC Name
(2R)-3-(phosphonooxy)propane-1,2-diyl didecanoate
Synonyms Sources
1,2-dicaprinyl-sn-glycero-3-phosphate ChEBI
1,2-Didecanoyl-3-phosphatidic acid ChemIDplus
1,2-Didecanoyl-3-sn-phosphatidic acid ChemIDplus
1,2-didecanoyl-sn-glycero-3-phosphate ChEBI
PA(10:0/10:0) LIPID MAPS
Manual Xrefs Databases
LMGP10010022 LIPID MAPS
XPA PDBeChem
View more database links
Registry Number Type Source
80164-20-1 CAS Registry Number ChemIDplus
Last Modified
03 September 2015