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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:09:11 UTC
Update Date2025-03-21 18:31:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00084183
Frequency34.1
Structure
Chemical FormulaC9H8O6
Molecular Mass212.0321
SMILESCC(=O)OC(=O)c1cc(O)c(O)c(O)c1
InChI KeyFBGDTWVOYBFDBZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzyloxycarbonyls
Direct Parent benzyloxycarbonyls
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzoic acids and derivatives
  • benzoyl derivatives
  • carbonyl compounds
  • carboxylic acid anhydrides
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • pyrogallols and derivatives
  • Substituents
  • benzyloxycarbonyl
  • carbonyl group
  • pyrogallol derivative
  • benzenetriol
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • benzoic acid or derivatives
  • 1-hydroxy-4-unsubstituted benzenoid
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • carboxylic acid anhydride
  • dicarboxylic acid or derivatives
  • phenol
  • hydrocarbon derivative
  • organooxygen compound