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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:11:01 UTC
Update Date2025-03-25 00:57:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02226645
Frequency0.5
Structure
Chemical FormulaC14H14N2O2
Molecular Mass242.1055
SMILESCC(O)C(O)c1ccc2[nH]c3ccccc3c2n1
InChI KeyMEOMSEDNEVCHJG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • 2-halopyridines
  • aromatic alcohols
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • methylpyridines
  • organonitrogen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • pyrroles
  • secondary alcohols
    • Substituents
  • aromatic alcohol
  • alcohol
  • azacycle
  • indole
  • polyhalopyridine
  • heteroaromatic compound
  • hydroxypyridine
  • methylpyridine
  • pyridine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • 2-halopyridine
  • organic nitrogen compound
  • organooxygen compound
  • 1,2-diol