Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:09:01 UTC
Update Date2025-03-24 19:55:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01078764
Frequency1.3
Structure
Chemical FormulaC6H9NO
Molecular Mass111.0684
SMILESO=C1CCC2CCN12
InChI KeyAGZLGRYFDGIVTG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactams
Subclass caprolactams
Direct Parent caprolactams
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • azepanes
  • azetidines
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • n-alkylpyrrolidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolidine-2-ones
  • tertiary carboxylic acid amides
  • Substituents
  • 2-pyrrolidone
  • caprolactam
  • carbonyl group
  • azacycle
  • n-alkylpyrrolidine
  • carboxamide group
  • carboxylic acid derivative
  • azetidine
  • aliphatic heteropolycyclic compound
  • organic oxide
  • azepane
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • pyrrolidone
  • organooxygen compound