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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:16:43 UTC
Update Date2025-03-21 18:34:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00102295
Frequency26.6
Structure
Chemical FormulaC9H10O4
Molecular Mass182.0579
SMILESOc1cc2c(cc1O)C(O)C(O)C2
InChI KeyGXGJPQFYIJGERR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classindanes
Subclass indanes
Direct Parent indanes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1,2-diols
  • 1-hydroxy-2-unsubstituted benzenoids
  • hydrocarbon derivatives
  • secondary alcohols
    • Substituents
  • alcohol
  • organic oxygen compound
  • indane
  • secondary alcohol
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • hydrocarbon derivative
  • organooxygen compound
  • 1,2-diol