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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:22:37 UTC
Update Date2025-03-25 01:01:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02253069
Frequency0.5
Structure
Chemical FormulaC15H18O10
Molecular Mass358.09
SMILESO=C(Cc1ccccc1C(=O)O)OC1OC(C(O)O)C(O)C(O)C1O
InChI KeyIJAWFANDJWVOTP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzoic acids and derivatives
Direct Parent benzoic acids
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-carboxy-2-haloaromatic compounds
  • acetals
  • benzoyl derivatives
  • carbonyl compounds
  • carbonyl hydrates
  • carboxylic acid esters
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
    • Substituents
  • carbonyl group
  • carboxylic acid
  • carbonyl hydrate
  • aromatic heteromonocyclic compound
  • benzoyl
  • monosaccharide
  • carboxylic acid derivative
  • saccharide
  • organic oxide
  • acetal
  • 1-carboxy-2-haloaromatic compound
  • benzoic acid
  • oxane
  • organoheterocyclic compound
  • alcohol
  • oxacycle
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organooxygen compound