Hmdb loader

Showing information for DMID02172077

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:13 UTC
Update Date2025-03-25 00:49:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02172077
Frequency0.5
Structure
Chemical FormulaC9H16N2O
Molecular Mass168.1263
SMILESCN1CCC2(CCC(=O)NC2)C1
InChI KeyATJHZWOMBQIYAN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazaspirodecane derivatives
Subclass azaspirodecane derivatives
Direct Parent azaspirodecane derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • amino acids and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • delta lactams
  • hydrocarbon derivatives
  • n-alkylpyrrolidines
  • organic oxides
  • organopnictogen compounds
  • piperidinones
  • secondary carboxylic acid amides
  • trialkylamines
    • Substituents
  • carbonyl group
  • lactam
  • amino acid or derivatives
  • carboxylic acid derivative
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • piperidinone
  • pyrrolidine
  • piperidine
  • tertiary amine
  • azacycle
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • carboxamide group
  • azaspirodecane
  • delta-lactam
  • secondary carboxylic acid amide
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound