Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:02:34 UTC
Update Date2025-03-24 16:37:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00920516
Frequency1.6
Structure
Chemical FormulaC5H9NO2
Molecular Mass115.0633
SMILESOC1CNC2COC12
InChI KeyHHWXUXKXMXAXBJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxazepines
Subclass 1,4-oxazepines
Direct Parent 1,4-oxazepines
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkyl ethers
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • oxacyclic compounds
  • oxetanes
  • pyrrolidines
  • secondary alcohols
  • Substituents
  • alcohol
  • secondary aliphatic amine
  • ether
  • azacycle
  • secondary amine
  • dialkyl ether
  • para-oxazepine
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • oxetane
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • organooxygen compound
  • amine