Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:38:56 UTC
Update Date2025-03-21 17:58:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00013029
Frequency346.0
Structure
Chemical FormulaC10H11NO
Molecular Mass161.0841
SMILESCC(=O)N1CCc2ccccc21
InChI KeyRNTCWULFNYNFGI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • acetamides
  • azacyclic compounds
  • benzenoids
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • tertiary carboxylic acid amides
  • Substituents
  • carbonyl group
  • azacycle
  • indole
  • carboxamide group
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • acetamide
  • organooxygen compound