Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:35 UTC
Update Date2025-03-25 00:55:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02214267
Frequency0.5
Structure
Chemical FormulaC13H20N2O2
Molecular Mass236.1525
SMILESCCc1ncc(C(CC)CC(=O)O)nc1CC
InChI KeyQWTCDUYWABVHGX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrazines
Direct Parent pyrazines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • pyrazine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound