CHEBI:78226 - 1,2-dicapryl-sn-glycero-3-phosphocholine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1,2-dicapryl-sn-glycero-3-phosphocholine
ChEBI ID CHEBI:78226
ChEBI ASCII Name 1,2-dicapryl-sn-glycero-3-phosphocholine
Definition A 1,2-diacyl-sn-glycero-3-phosphocholine 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.
Submitter Lucila Aimo
Supplier Information
Download Molfile XML SDF
Formula C28H56NO8P
Net Charge 0
Average Mass 565.71990
Monoisotopic Mass 565.37435
InChI InChI=1S/C28H56NO8P/c1-6-8-10-12-14-16-18-20-27(30)34-24-26(25-36-38(32,33)35-23-22-29(3,4)5)37-28(31)21-19-17-15-13-11-9-7-2/h26H,6-25H2,1-5H3/t26-/m1/s1
InChIKey MLKLDGSYMHFAOC-AREMUKBSSA-N
SMILES CCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCC
ChEBI Ontology
Outgoing 1,2-dicapryl-sn-glycero-3-phosphocholine (CHEBI:78226) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
1,2-dicapryl-sn-glycero-3-phosphocholine (CHEBI:78226) is a decanoate ester (CHEBI:87658)
IUPAC Name
(2R)-2,3-bis(decanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms Sources
1,2-dicaprinyl-sn-glycero-3-phosphocholine betaine ChEBI
1,2-didecanoyl-sn-glycero-3-phosphocholine UniProt
1,2-didecanoyl-sn-glycero-3-phosphocholine betaine SUBMITTER
didecanoyl-L-α-glycerophosphorylcholine LIPID MAPS
Didecanoyl-L-alpha-phosphatidylcholine ChemIDplus
Didecanoylglycerophosphocholine LIPID MAPS
Didecanoyllecithin LIPID MAPS
Didecanoylphosphatidylcholine LIPID MAPS
L-dicapryllecithin LIPID MAPS
L-didecanoyllecithin LIPID MAPS
L-didecanoylphosphatidylcholine LIPID MAPS
PC 10:0/10:0 betaine SUBMITTER
Manual Xrefs Databases
LMGP01010380 LIPID MAPS
P1O PDBeChem
View more database links
Registry Numbers Types Sources
3436-44-0 CAS Registry Number ChemIDplus
3757665 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
2041726 PubMed citation Europe PMC
406914 PubMed citation Europe PMC
6643425 PubMed citation Europe PMC
Last Modified
03 September 2015