RefMet Compound Details

MW structure1284 (View MW Metabolite Database details)
RefMet name2-Hydroxyvaleric acid
Alternative nameFA 5:0;2OH
Systematic name2-hydroxy-pentanoic acid
SMILESCCCC(C(=O)O)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Sum CompositionFA 5:0;O View other entries in RefMet with this sum composition
Exact mass118.062995 (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
FormulaC5H10O3View other entries in RefMet with this formula
InChIKeyJRHWHSJDIILJAT-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassFatty Acyls
Main ClassFatty acids
Sub ClassHydroxy FA
Pubchem CID98009
Annotation level2   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)