CHEBI:86168 - 1-hexadecanoyl-2-docosanoyl-sn-glycero-3-phosphocholine

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ChEBI Name 1-hexadecanoyl-2-docosanoyl-sn-glycero-3-phosphocholine
ChEBI ID CHEBI:86168
ChEBI ASCII Name 1-hexadecanoyl-2-docosanoyl-sn-glycero-3-phosphocholine
Definition A phosphatidylcholine 38:0 in which the acyl groups specified at positions 1 and 2 are hexadecanoyl and docosanoyl respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C46H92NO8P
Net Charge 0
Average Mass 818.19830
Monoisotopic Mass 817.65606
InChI InChI=1S/C46H92NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-27-29-31-33-35-37-39-46(49)55-44(43-54-56(50,51)53-41-40-47(3,4)5)42-52-45(48)38-36-34-32-30-28-26-19-17-15-13-11-9-7-2/h44H,6-43H2,1-5H3/t44-/m1/s1
InChIKey GHBAFISLPNCOEP-USYZEHPZSA-N
SMILES CCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP([O-])(=O)OCC[N+](C)(C)C
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via phosphatidylcholine 38:0 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-hexadecanoyl-2-docosanoyl-sn-glycero-3-phosphocholine (CHEBI:86168) has functional parent docosanoic acid (CHEBI:28941)
1-hexadecanoyl-2-docosanoyl-sn-glycero-3-phosphocholine (CHEBI:86168) has functional parent hexadecanoic acid (CHEBI:15756)
1-hexadecanoyl-2-docosanoyl-sn-glycero-3-phosphocholine (CHEBI:86168) is a phosphatidylcholine 38:0 (CHEBI:66861)
IUPAC Name
(2R)-2-(docosanoyloxy)-3-(hexadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms Sources
1-Palmitoyl-2-behenoyl-sn-glycero-3-phosphocholine HMDB
GPCho(16:0/22:0) HMDB
PC(16:0/22:0) LIPID MAPS
Phosphatidylcholine(16:0/22:0) HMDB
Manual Xrefs Databases
HMDB0007985 HMDB
LMGP01010636 LIPID MAPS
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Last Modified
25 June 2015