Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:16:00 UTC
Update Date2025-03-24 20:40:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01528624
Frequency0.8
Structure
Chemical FormulaC8H13NO
Molecular Mass139.0997
SMILESCN1CCC2C(=O)CCC21
InChI KeyKIDOIBKGBGMMHU-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
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • carbonyl group
  • azacycle
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • ketone
  • aliphatic heteropolycyclic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound