Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:41:12 UTC
Update Date2025-03-21 20:00:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00299331
Frequency6.6
Structure
Chemical FormulaC7H9N
Molecular Mass107.0735
SMILESC=CCn1cccc1
InChI KeyJHFNJRVFKOQALR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrroles
Subclass substituted pyrroles
Direct Parent substituted pyrroles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • substituted pyrrole
  • organic nitrogen compound