CHEBI:138213 - 1-octadecanoyl-2-octanoyl-sn-glycero-3-phosphocholine

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ChEBI Name 1-octadecanoyl-2-octanoyl-sn-glycero-3-phosphocholine
ChEBI ID CHEBI:138213
ChEBI ASCII Name 1-octadecanoyl-2-octanoyl-sn-glycero-3-phosphocholine
Definition A phosphatidylcholine 26:0 in which the acyl groups at positions 1 and 2 are specified as octadecanoyl and octanoyl respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Lucila Aimo
Supplier Information
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Formula C34H68NO8P
Net Charge 0
Average Mass 649.881
Monoisotopic Mass 649.46826
InChI InChI=1S/C34H68NO8P/c1-6-8-10-12-13-14-15-16-17-18-19-20-21-23-24-26-33(36)40-30-32(43-34(37)27-25-22-11-9-7-2)31-42-44(38,39)41-29-28-35(3,4)5/h32H,6-31H2,1-5H3/t32-/m1/s1
InChIKey DLNRUGDIZLLLEA-JGCGQSQUSA-N
SMILES P(OC[C@@H](COC(CCCCCCCCCCCCCCCCC)=O)OC(=O)CCCCCCC)(=O)(OCC[N+](C)(C)C)[O-]
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 26:0 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-octadecanoyl-2-octanoyl-sn-glycero-3-phosphocholine (CHEBI:138213) has functional parent octadecanoic acid (CHEBI:28842)
1-octadecanoyl-2-octanoyl-sn-glycero-3-phosphocholine (CHEBI:138213) has functional parent octanoic acid (CHEBI:28837)
1-octadecanoyl-2-octanoyl-sn-glycero-3-phosphocholine (CHEBI:138213) is a phosphatidylcholine 26:0 (CHEBI:72423)
IUPAC Name
(2R)-3-(octadecanoyloxy)-2-(octanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms Sources
1-octadecanoyl-2-octanoyl-sn-glycero-3-phosphocholine UniProt
1-stearoyl-2-capryloyl-sn-glycero-3-phosphocholine ChEBI
1-stearoyl-2-octanoyl-sn-glycero-3-phosphocholine ChEBI
PC(18:0/8:0) SUBMITTER
phosphatidylcholine 18:0/8:0 ChEBI
Citations Waiting for Citations Types Sources
21926997 PubMed citation SUBMITTER
9449334 PubMed citation Europe PMC
Last Modified
02 November 2017