Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:44:59 UTC
Update Date2025-03-25 00:48:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02167023
Frequency0.5
Structure
Chemical FormulaC10H11N3O2
Molecular Mass205.0851
SMILESCC(=O)OCCn1cccc2ncnc1-2
InChI KeyXGRKWLLJAQBGQI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyridines
Subclass imidazopyridines
Direct Parent imidazopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acid esters
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • methylpyridines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • Substituents
  • carbonyl group
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • methylpyridine
  • imidazopyridine
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • pyridine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • imidazole
  • carboxylic acid ester
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • organooxygen compound
  • azole