Metabolomics Structure Database

 
MW REGNO: 14696
Common Name:PC(O-18:0/2:0)
Systematic Name:1-octadecyl-2-acetyl-sn-glycero-3-phosphocholine
Synonyms:PAF; Platelet-activating factor; 3,5,9-Trioxa-4-phosphaheptacosan-1-aminium, 7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-, inner salt, 4-oxide, (R)-; 1-O-Octadecyl-2-acetyl-sn-glyceryl-3-phosphorylcholine; 1-O-Octadecyl-platelet-activating factor; 1-O-Stearoyl-2-acetyl-sn-glyceryl-3-phosphorylcholine; Blood platelet activating factor-acether; Blood platelet-activating factor; C18-PAF; C18-PAF-acether; PAF; PAF acether; Platelet activating factor-acether; Platelet-activating factor; Ro 14-8161 [PubChem Synonyms]
Exact Mass:
551.3951 (neutral)    Calculate m/z:
Formula:C28H58NO7P
InChIKey:ZXCIEWBDUAPBJF-MUUNZHRXSA-N
LIPID MAPS Category:Glycerophospholipids [GP]
LIPID MAPS mainclass:Glycerophosphocholines [GP01]
LIPID MAPS subclass:1-alkyl,2-acylglycerophosphocholines [GP0102]
SMILES:CCCCCCCCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)C
Studies:Available studies(via PubChem CID)

Select appropriate tab below to view additional details:

External database links:

PubChem CID:2733535
LIPID MAPS ID:LMGP01020094
CHEBI ID:52450

References

LIPID MAPS classification: "Update of the LIPID MAPS comprehensive classification system for lipids", Fahy E, Subramaniam S, Murphy RC, Nishijima M, Raetz CR, Shimizu T, Spener F, van Meer G, Wakelam MJ, and Dennis EA, J. Lipid Res. (2009) 50: S9-S14. DOI: 10.1194/jlr.R800095-JLR200
ClassyFire classification: "ClassyFire: automated chemical classification with a comprehensive, computable taxonomy", Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS, J. Cheminformatics (2016) 8:61. DOI: 10.1186/s13321-016-0174-y

  logo