Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:01:02 UTC
Update Date2025-03-21 18:06:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00064602
Frequency47.6
Structure
Chemical FormulaC9H11NO
Molecular Mass149.0841
SMILESCN1CC(O)c2ccccc21
InChI KeyBWQZQQAIJBDGBR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • azacyclic compounds
  • benzenoids
  • dialkylarylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • azacycle
  • 1,2-aminoalcohol
  • indole
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • tertiary aliphatic/aromatic amine
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • dialkylarylamine
  • amine
  • tertiary amine
  • organooxygen compound