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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:19:35 UTC
Update Date2025-03-21 18:36:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00109353
Frequency24.5
Structure
Chemical FormulaC10H4O6
Molecular Mass220.0008
SMILESO=C1OC(=O)c2cc(O)c(O)c3occ1c23
InChI KeyNZQIRSTXMISZQJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 2-benzopyrans
Direct Parent 2-benzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • benzenoids
  • benzofurans
  • carboxylic acid anhydrides
  • dicarboxylic acids and derivatives
  • furoic acid and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactones
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
    • Substituents
  • furan
  • furoic acid or derivatives
  • benzofuran
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • lactone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • 2-benzopyran
  • carboxylic acid anhydride
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound