RefMet Compound Details

MW structure38057 (View MW Metabolite Database details)
RefMet nameN1,N12-Diacetylspermine
Systematic nameN-[3-({4-[(3-acetamidopropyl)amino]butyl}amino)propyl]acetamide
SMILESCC(=O)NCCCNCCCCNCCCNC(=O)C   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass286.236876 (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
FormulaC14H30N4O2View other entries in RefMet with this formula
InChIKeyNPDTUDWGJMBVEP-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassAlkaloids
Main ClassOrnithine alkaloids
Sub ClassPolyamines
Pubchem CID132680
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)