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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:07:33 UTC
Update Date2025-03-25 00:56:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02218806
Frequency0.5
Structure
Chemical FormulaC11H15NO2
Molecular Mass193.1103
SMILESCNCC1c2ccccc2C(O)C1O
InChI KeyKIYIYTXJMPJSQI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classindanes
Subclass indanes
Direct Parent indanes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1,2-diols
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • secondary aliphatic amine
  • aromatic homopolycyclic compound
  • secondary amine
  • organic oxygen compound
  • indane
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine
  • 1,2-diol