Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:05:51 UTC
Update Date2025-03-25 01:18:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02352782
Frequency0.5
Structure
Chemical FormulaC6H11NO2
Molecular Mass129.079
SMILESCN1CCC2OC(O)C21
InChI KeyDKCHRFKPSGKJAG-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
  • hemiacetals
  • hydrocarbon derivatives
  • n-alkylpyrrolidines
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxetanes
  • trialkylamines
  • Substituents
  • azacycle
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • para-oxazepine
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • oxetane
  • organonitrogen compound
  • organopnictogen compound
  • hemiacetal
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • amine
  • tertiary amine
  • organooxygen compound