Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:14:22 UTC
Update Date2025-03-21 22:13:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00519038
Frequency3.3
Structure
Chemical FormulaC7H13NO2
Molecular Mass143.0946
SMILESCN1C2COCC1C(O)C2
InChI KeyYQYLSSXHLBKTNP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • azacyclic compounds
  • dialkyl ethers
  • hydrocarbon derivatives
  • morpholines
  • n-alkylpyrrolidines
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary alcohols
  • trialkylamines
  • Substituents
  • alcohol
  • ether
  • azacycle
  • n-alkylpyrrolidine
  • 1,2-aminoalcohol
  • tertiary aliphatic amine
  • dialkyl ether
  • oxazinane
  • aliphatic heteropolycyclic compound
  • oxepane
  • oxacycle
  • morpholine
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • amine
  • tertiary amine
  • organooxygen compound