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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:27:03 UTC
Update Date2025-03-21 18:39:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00127149
Frequency20.1
Structure
Chemical FormulaC10H10O5
Molecular Mass210.0528
SMILESCOc1ccc(C(C(=O)O)C(=O)O)cc1
InChI KeyHKGWZPGNUJEGCT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass anisoles
Direct Parent anisoles
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1,3-dicarbonyl compounds
  • alkyl aryl ethers
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • methoxybenzenes
  • organic oxides
  • phenoxy compounds
    • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • carboxylic acid
  • alkyl aryl ether
  • carboxylic acid derivative
  • methoxybenzene
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • anisole
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • 1,3-dicarbonyl compound
  • phenoxy compound
  • organooxygen compound