Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:11 UTC
Update Date2025-03-25 00:50:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02181226
Frequency0.5
Structure
Chemical FormulaC12H16N2O2
Molecular Mass220.1212
SMILESO=C(O)CC(c1cccnc1)C1CCCN1
InChI KeyUHIYQUQEEVIAPO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydroxypyridines
Direct Parent hydroxypyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • pyrrolidines
  • Substituents
  • secondary aliphatic amine
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • azacycle
  • amino acid or derivatives
  • amino acid
  • heteroaromatic compound
  • hydroxypyridine
  • secondary amine
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • organooxygen compound
  • amine