Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:16:57 UTC
Update Date2025-03-25 00:59:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02239991
Frequency0.5
Structure
Chemical FormulaC11H13N3O
Molecular Mass203.1059
SMILESO=C1N(c2cccnc2)CC2CCCN12
InChI KeyRGQDCHCOQPVATE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass pyridines and derivatives
Direct Parent pyridines and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazolidinones
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolidines
  • ureas
  • Substituents
  • imidazolidine
  • carbonyl group
  • carbonic acid derivative
  • azacycle
  • heteroaromatic compound
  • urea
  • imidazolidinone
  • organic oxide
  • pyridine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • organooxygen compound