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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:44:28 UTC
Update Date2025-03-25 00:48:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02165810
Frequency0.5
Structure
Chemical FormulaC10H8O5
Molecular Mass208.0372
SMILESCC1C(=O)Oc2cc(O)c(C(=O)O)cc21
InChI KeySRPGVXJJYSMORO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzofurans
Subclass benzofuranones
Direct Parent benzofuranones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-carboxy-2-haloaromatic compounds
  • 1-hydroxy-2-unsubstituted benzenoids
  • benzenoids
  • carbonyl compounds
  • carboxylic acid esters
  • coumarans
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • lactones
  • organic oxides
  • oxacyclic compounds
  • salicylic acid and derivatives
  • vinylogous acids
  • Substituents
  • carbonyl group
  • carboxylic acid
  • benzofuranone
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • hydroxybenzoic acid
  • lactone
  • oxacycle
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • salicylic acid or derivatives
  • aromatic heteropolycyclic compound
  • carboxylic acid ester
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • benzenoid
  • 1-carboxy-2-haloaromatic compound
  • coumaran
  • organooxygen compound