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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:08 UTC
Update Date2025-03-25 00:57:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02222481
Frequency0.5
Structure
Chemical FormulaC11H10N2O2
Molecular Mass202.0742
SMILESO=C1NCCc2c1[nH]c1cc(O)ccc21
InChI KeyHHVHBADITZEWDO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass pyridoindoles
Direct Parent beta carbolines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 2-heteroaryl carboxamides
  • azacyclic compounds
  • benzenoids
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • indolecarboxylic acids and derivatives
  • indoles
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • pyrroles
  • secondary carboxylic acid amides
  • Substituents
  • lactam
  • indole
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • 2-heteroaryl carboxamide
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • indolecarboxylic acid derivative
  • azacycle
  • heteroaromatic compound
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxygen compound
  • pyrrole
  • beta-carboline
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound