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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:20:24 UTC
Update Date2025-03-21 18:36:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00111319
Frequency23.9
Structure
Chemical FormulaC9H10N2O2
Molecular Mass178.0742
SMILESCOc1ccc2[nH]c(=O)n(C)c2c1
InChI KeyUYRGCEBXOCYGKP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzimidazoles
Subclass benzimidazoles
Direct Parent benzimidazoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • n-substituted imidazoles
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • phenol ether
  • ether
  • carbonic acid derivative
  • azacycle
  • heteroaromatic compound
  • alkyl aryl ether
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • benzimidazole
  • imidazole
  • anisole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound
  • azole
  • n-substituted imidazole