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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:20 UTC
Update Date2025-03-25 00:54:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02208922
Frequency0.5
Structure
Chemical FormulaC13H14O2
Molecular Mass202.0994
SMILESCC(C)=CC1Cc2cc(O)ccc2C1=O
InChI KeyLSTBGDZCCUQGHH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classindanes
Subclass indanones
Direct Parent indanones
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • aryl alkyl ketones
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
    • Substituents
  • aryl alkyl ketone
  • indanone
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • ketone
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound
  • aryl ketone