RefMet Compound Details

MW structure37334 (View MW Metabolite Database details)
RefMet name2-Furoic acid
Systematic namefuran-2-carboxylic acid
SMILESc1cc(C(=O)O)oc1   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass112.016045 (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
FormulaC5H4O3View other entries in RefMet with this formula
InChIKeySMNDYUVBFMFKNZ-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassOrganoheterocyclic compounds
Main ClassFuroic acids
Sub ClassFuroic acid derivatives
Pubchem CID6919
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)