Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:48:22 UTC
Update Date2025-03-21 18:01:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00034604
Frequency103.8
Structure
Chemical FormulaC8H9NO
Molecular Mass135.0684
SMILESOC1CNc2ccccc21
InChI KeyPXHUCPJKTHEEPU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • hydrocarbon derivatives
  • indolines
  • organopnictogen compounds
  • secondary alcohols
  • secondary alkylarylamines
  • Substituents
  • alcohol
  • azacycle
  • indole
  • secondary amine
  • secondary aliphatic/aromatic amine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • dihydroindole
  • amine
  • organooxygen compound