Metabolomics Structure Database

 
MW REGNO: 65898
Common Name:C20 sphingosine
Systematic Name:(2S,3R,4E)-2-aminoicos-4-ene-1,3-diol
RefMet Name:C20 Sphingosine
Synonyms:(2S,3R,4E)-2-aminoeicos-4-ene-1,3-diol; C20 sphing-4-enine; eicosasphing-4-enine; eicosasphingosine; icosasphing-4-enine; icosasphingosine [PubChem Synonyms]
Exact Mass:
327.3137 (neutral)    Calculate m/z:
Formula:C20H41NO2
InChIKey:HTJSZHKGNMXZJN-YIVRLKKSSA-N
LIPID MAPS Category:Sphingolipids
LIPID MAPS mainclass:Sphingoid bases
LIPID MAPS subclass:Sphingoid base analogs
SMILES:CCCCCCCCCCCCCCC/C=C/[C@H]([C@H](CO)N)O
Studies:Available studies (via RefMet name)

Select appropriate tab below to view additional details:

External database links:

PubChem CID:9862210
LIPID MAPS ID:LMSP01040009
CHEBI ID:71982

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