Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:15:20 UTC
Update Date2025-03-24 21:33:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01814315
Frequency0.7
Structure
Chemical FormulaC6H13NO2
Molecular Mass131.0946
SMILESCOC1CN(C)CC1O
InChI KeyWVGMGFKCXPENCY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass n-alkylpyrrolidines
Direct Parent n-alkylpyrrolidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • azacyclic compounds
  • dialkyl ethers
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alcohols
  • trialkylamines
  • Substituents
  • alcohol
  • ether
  • azacycle
  • n-alkylpyrrolidine
  • 1,2-aminoalcohol
  • tertiary aliphatic amine
  • dialkyl ether
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound