RefMet Compound Details

MW structure156944 (View MW Metabolite Database details)
RefMet nameC20 Sphinganine
Systematic name(2S,3R)-2-aminoicosane-1,3-diol
SMILESCCCCCCCCCCCCCCCCC[C@H]([C@H](CO)N)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass329.329379 (neutral)
Calculate m/z:   
View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC20H43NO2View other entries in RefMet with this formula
InChIKeyUFMHYBVQZSPWSS-VQTJNVASSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassSphingolipids
Main ClassSphingoid bases
Sub ClassSphingoid base analogs
Pubchem CID11616885
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)