Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:11:26 UTC
Update Date2025-03-25 00:57:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02227574
Frequency0.5
Structure
Chemical FormulaC11H11N3O
Molecular Mass201.0902
SMILESCC(=O)CC1=NN=C(c2cccnc2)C1
InChI KeyBKAFMNGFLXMEBS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass methylpyridines
Direct Parent methylpyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • methylpyridine
  • ketone
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound