Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:20:24 UTC
Update Date2025-03-25 01:23:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02386258
Frequency0.5
Structure
Chemical FormulaC7H15NO
Molecular Mass129.1154
SMILESCOC1CC(C)N(C)C1
InChI KeyKMSJGKZSRQFLOS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass n-alkylpyrrolidines
Direct Parent n-alkylpyrrolidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkyl ethers
  • hydrocarbon derivatives
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • ether
  • azacycle
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • dialkyl ether
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound