CHEBI:78044 - 1-oleoyl-2-acetyl-sn-glycero-3-phosphocholine

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ChEBI Name 1-oleoyl-2-acetyl-sn-glycero-3-phosphocholine
ChEBI ID CHEBI:78044
ChEBI ASCII Name 1-oleoyl-2-acetyl-sn-glycero-3-phosphocholine
Definition A 1-oleoyl-2-acyl-sn-glycero-3-phosphocholine in which the acyl substituent at position 2 is specified as acetyl.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Nevila Nouspikel
Supplier Information
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Formula C28H54NO8P
Net Charge 0
Average Mass 563.70400
Monoisotopic Mass 563.35870
InChI InChI=1S/C28H54NO8P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-28(31)34-24-27(37-26(2)30)25-36-38(32,33)35-23-22-29(3,4)5/h13-14,27H,6-12,15-25H2,1-5H3/b14-13-/t27-/m1/s1
InChIKey WHHNGIKQIRHPSY-ZYRNGQCSSA-N
SMILES CCCCCCCC\C=C/CCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(C)=O
ChEBI Ontology
Outgoing 1-oleoyl-2-acetyl-sn-glycero-3-phosphocholine (CHEBI:78044) is a 1-oleoyl-2-acyl-sn-glycero-3-phosphocholine (CHEBI:78421)
IUPAC Name
(2R)-2-acetoxy-3-[(9Z)-octadec-9-enoyloxy]propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms Sources
1-(9Z)-octadecenoyl-2-acetyl-sn-glycero-3-phosphocholine ChEBI
1-(9Z-octadecenoyl)-2-acetyl-sn-glycero-3-phosphocholine LIPID MAPS
1-O-(9Z)-octadecenoyl-2-O-acetyl-sn-glycero-3-phosphocholine UniProt
PC(18:1(9Z)/2:0) LIPID MAPS
PC(18:1/2:0) LIPID MAPS
Manual Xref Database
LMGP01010900 LIPID MAPS
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Citation Waiting for Citations Type Source
8119970 PubMed citation SUBMITTER
Last Modified
17 June 2014