Metabolomics Structure Database

 
MW REGNO: 30730
Common Name:SM(d18:1/20:0)
Systematic Name:N-(eicosanoyl)-sphing-4-enine-1-phosphocholine
Synonyms:C20 Sphingomyelin [PubChem Synonyms]
Exact Mass:
758.6302 (neutral)    Calculate m/z:
Formula:C43H87N2O6P
InChIKey:AADLTHQNYQJHQV-SVLGDMRNSA-N
LIPID MAPS Category:Sphingolipids [LMSP]
LIPID MAPS mainclass:Phosphosphingolipids [LMSP03]
LIPID MAPS subclass:Ceramide phosphocholines (sphingomyelins) [LMSP0301]
MoNA MS spectra:View spectra
Studies:Available studies

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External database links:

PubChem CID:44260124
LIPID MAPS ID:LMSP03010005
CHEBI ID:83359
HMDB ID:HMDB0012102
Chemspider ID:23113477

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

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