RefMet Compound Details

MW structure37797 (View MW Metabolite Database details)
RefMet nameAgmatine
Systematic name1-(4-aminobutyl)guanidine
SMILESNCCCCNC(N)=N
Exact mass130.121846 (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
FormulaC5H14N4View other entries in RefMet with this formula
InChIInChI=1S/C5H14N4/c6-3-1-2-4-9-5(7)8/h1-4,6H2,(H4,7,8,9)
InChIKeyQYPPJABKJHAVHS-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassOrganic nitrogen compounds
Main ClassGuanidines
Sub ClassGuanidines
Pubchem CID199
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving Agmatine

Rxn IDKEGG ReactionEnzyme
R00566 L-Arginine <=> Agmatine + CO2L-arginine carboxy-lyase (agmatine-forming)
R01157 Agmatine + H2O <=> Putrescine + UreaAgmatine amidinohydrolase

Table of KEGG human pathways containing Agmatine

Pathway IDHuman Pathway# of reactions
hsa00330 Arginine and proline metabolism 2
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