RefMet Compound Details

MW structure38375 (View MW Metabolite Database details)
RefMet name2-Aminoacrylic acid
Systematic name2-aminoprop-2-enoic acid
SMILESC=C(C(=O)O)N   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass87.032029 (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
FormulaC3H5NO2View other entries in RefMet with this formula
InChIInChI=1S/C3H5NO2/c1-2(4)3(5)6/h1,4H2,(H,5,6)
InChIKeyUQBOJOOOTLPNST-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassOrganic acids
Main ClassAmino acids and peptides
Sub ClassAmino acids
Pubchem CID123991
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving 2-Aminoacrylic acid

Rxn IDKEGG ReactionEnzyme
R00590 L-Serine <=> Dehydroalanine + H2OL-serine hydro-lyase

Table of KEGG human pathways containing 2-Aminoacrylic acid

Pathway IDHuman Pathway# of reactions
hsa00270 Cysteine and methionine metabolism 1
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