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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:59:42 UTC
Update Date2025-03-25 00:53:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02200579
Frequency0.5
Structure
Chemical FormulaC10H14N2O2
Molecular Mass194.1055
SMILESCOc1ccc(C2CC(O)CN2)cn1
InChI KeyLQHYRGVNGQBZAR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass pyrrolidinylpyridines
Direct Parent pyrrolidinylpyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • alkyl aryl ethers
  • azacyclic compounds
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • methylpyridines
  • organopnictogen compounds
  • polyhalopyridines
  • pyrrolidines
  • secondary alcohols
    • Substituents
  • ether
  • aromatic heteromonocyclic compound
  • pyrrolidinylpyridine
  • polyhalopyridine
  • alkyl aryl ether
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • pyrrolidine
  • alcohol
  • secondary aliphatic amine
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • methylpyridine
  • secondary amine
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine