Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:20:17 UTC
Update Date2025-03-24 20:16:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01395609
Frequency0.9
Structure
Chemical FormulaC7H11NO
Molecular Mass125.0841
SMILESCN1CCC2OC=CC21
InChI KeyVRMMCDPGUJLQOX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass n-alkylpyrrolidines
Direct Parent n-alkylpyrrolidines
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • dihydrofurans
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • trialkylamines
  • Substituents
  • azacycle
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound
  • dihydrofuran