Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:59 UTC
Update Date2025-03-25 00:52:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02194307
Frequency0.5
Structure
Chemical FormulaC13H11N3O
Molecular Mass225.0902
SMILESCN1C(=O)c2cnccc2C1c1cccnc1
InChI KeyITMXDPIBWABMDZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolopyridines
Subclass pyrrolopyridines
Direct Parent pyrrolopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • methylpyridines
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • pyrroles
  • tertiary carboxylic acid amides
  • Substituents
  • lactam
  • azacycle
  • pyrrolopyridine
  • polyhalopyridine
  • heteroaromatic compound
  • methylpyridine
  • carboxamide group
  • carboxylic acid derivative
  • organic oxide
  • pyridine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound