Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:23:22 UTC
Update Date2025-03-21 18:38:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00118535
Frequency22.0
Structure
Chemical FormulaC13H13N3
Molecular Mass211.1109
SMILESCn1cncc1Cc1c[nH]c2ccccc12
InChI KeyOEJYYGXQNAQJBQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • n-substituted imidazoles
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • azacycle
  • indole
  • heteroaromatic compound
  • aromatic heteropolycyclic compound
  • imidazole
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • azole
  • n-substituted imidazole