RefMet Compound Details

MW structure37023 (View MW Metabolite Database details)
RefMet name1,3-Diaminopropane
Systematic namepropane-1,3-diamine
SMILESC(CN)CN   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass74.084398 (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
FormulaC3H10N2View other entries in RefMet with this formula
InChIKeyXFNJVJPLKCPIBV-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassFatty Acyls
Main ClassFatty amines
Sub ClassMonoalkylamines
Pubchem CID428
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving 1,3-Diaminopropane

Rxn IDKEGG ReactionEnzyme
R03139 1,3-Diaminopropane + Oxygen + H2O <=> 3-Aminopropanal + Ammonia + Hydrogen peroxideprimary-amine oxidase

Table of KEGG human pathways containing 1,3-Diaminopropane

Pathway IDHuman Pathway# of reactions
hsa00410 beta-Alanine metabolism 1