Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:21:58 UTC
Update Date2025-03-21 20:53:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00395059
Frequency4.6
Structure
Chemical FormulaC7H8N2
Molecular Mass120.0687
SMILESCn1ccc2[nH]ccc21
InChI KeyTUURTCUVTCUQLT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrroles
Subclass substituted pyrroles
Direct Parent substituted pyrroles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • n-methylpyrroles
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • n-methylpyrrole
  • azacycle
  • aromatic heteropolycyclic compound
  • heteroaromatic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • substituted pyrrole
  • organic nitrogen compound