Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:16:24 UTC
Update Date2025-03-21 18:34:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00101496
Frequency26.9
Structure
Chemical FormulaC9H10O3
Molecular Mass166.063
SMILESO=C(c1ccccc1)C(O)CO
InChI KeyJOMKEHIPJGGZKN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alkyl-phenylketones
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1,2-diols
  • acyloins
  • aryl alkyl ketones
  • benzoyl derivatives
  • beta-hydroxy ketones
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • primary alcohols
  • secondary alcohols
  • Substituents
  • alcohol
  • beta-hydroxy ketone
  • monocyclic benzene moiety
  • aryl alkyl ketone
  • benzoyl
  • monosaccharide
  • aromatic homomonocyclic compound
  • saccharide
  • organic oxide
  • acyloin
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • primary alcohol
  • alkyl-phenylketone
  • 1,2-diol