Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:12:13 UTC
Update Date2025-03-24 16:43:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00943599
Frequency1.5
Structure
Chemical FormulaC6H13NO2
Molecular Mass131.0946
SMILESNCC1CC(O)CCO1
InChI KeyVBENVBYCUIRSQU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxanes
Subclass oxanes
Direct Parent oxanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • ether
  • dialkyl ether
  • oxacycle
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • oxane
  • organooxygen compound