Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:02:11 UTC
Update Date2025-03-24 20:34:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01494702
Frequency0.9
Structure
Chemical FormulaC8H13NO
Molecular Mass139.0997
SMILESCC(=O)N1CC2CCC2C1
InChI KeyYRGKIBHEDNLBCW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass n-acylpyrrolidines
Direct Parent n-acylpyrrolidines
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • acetamides
  • azacyclic compounds
  • azepanes
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • tertiary carboxylic acid amides
  • Substituents
  • carbonyl group
  • azacycle
  • n-acylpyrrolidine
  • carboxamide group
  • carboxylic acid derivative
  • aliphatic heteropolycyclic compound
  • organic oxide
  • azepane
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • acetamide
  • organooxygen compound