Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:02:55 UTC
Update Date2025-03-21 18:07:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00069153
Frequency50.1
Structure
Chemical FormulaC10H9NO3
Molecular Mass191.0582
SMILESCC(=O)OC1C(=O)Nc2ccccc21
InChI KeyJTYPCTLDANMIPD-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
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • indolines
  • lactams
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • carbonyl group
  • lactam
  • azacycle
  • indole
  • carboxamide group
  • carboxylic acid derivative
  • secondary carboxylic acid amide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • carboxylic acid ester
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • dihydroindole
  • organooxygen compound