RefMet Compound Details

MW structure37280 (View MW Metabolite Database details)
RefMet name4-Hydroxybenzoic acid
Systematic name4-hydroxybenzoic acid
SMILESOc1ccc(cc1)C(O)=O
Exact mass138.031695 (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
FormulaC7H6O3View other entries in RefMet with this formula
InChIInChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)
InChIKeyFJKROLUGYXJWQN-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassBenzenoids
Main ClassBenzoic acids
Sub ClassHydroxybenzoic acids
Pubchem CID135
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

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

Rxn IDKEGG ReactionEnzyme
R05000 all-trans-Polyprenyl diphosphate + 4-Hydroxybenzoate <=> 4-Hydroxy-3-polyprenylbenzoate + Diphosphatepolyisopentenylpyrolinate:4-hydroxybenzoate nonaprenyltransferase
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