RefMet Compound Details

RefMet IDRM0042346
MW structure38386 (View MW Metabolite Database details)
RefMet name4-Acetamidobutanoic acid   Species distribution   Sample source distribution
Systematic name4-acetamidobutanoic acid
SMILESCC(=O)NCCCC(=O)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass145.073894 (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
FormulaC6H11NO3View other entries in RefMet with this formula
InChIInChI=1S/C6H11NO3/c1-5(8)7-4-2-3-6(9)10/h2-4H2,1H3,(H,7,8)(H,9,10)
InChIKeyUZTFMUBKZQVKLK-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassOrganic acids
Main ClassAmino acids and peptides
Sub ClassAmino acids
Pubchem CID18189
ChEBI ID17645
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving 4-Acetamidobutanoic acid

Rxn IDKEGG ReactionEnzyme
R05050 N4-Acetylaminobutanal + NAD+ + H2O <=> 4-Acetamidobutanoate + NADH + H+N4-Acetylaminobutanal:NAD+ oxidoreductase

Table of KEGG human pathways containing 4-Acetamidobutanoic acid

Pathway IDHuman Pathway# of reactions
hsa00330 Arginine and proline metabolism 1
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