RefMet Compound Details

RefMet IDRM0038393
MW structure41435 (View MW Metabolite Database details)
RefMet nameNorspermidine
Systematic namebis(3-aminopropyl)amine
SMILESC(CN)CNCCCN   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass131.142248 (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
FormulaC6H17N3View other entries in RefMet with this formula
InChIInChI=1S/C6H17N3/c7-3-1-5-9-6-2-4-8/h9H,1-8H2
InChIKeyOTBHHUPVCYLGQO-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassAlkaloids
Main ClassOrnithine alkaloids
Sub ClassPolyamines
Pubchem CID5942
ChEBI ID16841
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
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