RefMet Compound Details

MW structure52332 (View MW Metabolite Database details)
RefMet namePhenyllactic acid
Systematic name2-hydroxy-3-phenylpropanoic acid
Canonical SMILESOC(=O)[C@@H](O)Cc1ccccc1
Exact mass166.0630View other entries in RefMet with this exact mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC9H10O3View other entries in RefMet with this formula
InChIInChI=1S/C9H10O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)/t8-/m0/s1
InChIKeyVOXXWSYKYCBWHO-QMMMGPOBSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassPolyketides
Main ClassPhenylpropanoids
Sub classPhenylpropanoic acids
Pubchem CID444718
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