Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:44:25 UTC
Update Date2025-03-24 14:33:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00876922
Frequency1.7
Structure
Chemical FormulaC7H11NO
Molecular Mass125.0841
SMILESCc1cc(CO)n(C)c1
InChI KeyNGXJJRABUUKJRN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrroles
Subclass substituted pyrroles
Direct Parent substituted pyrroles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • n-methylpyrroles
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aromatic alcohol
  • alcohol
  • n-methylpyrrole
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • substituted pyrrole
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound