Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:25:38 UTC
Update Date2025-03-25 01:25:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02398302
Frequency0.5
Structure
Chemical FormulaC5H7NO3
Molecular Mass129.0426
SMILESO=C1CC2OC(O)C2N1
InChI KeyWNSDAEGPCDYSFN-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
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hemiacetals
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxetanes
  • pyrrolidine-2-ones
  • secondary carboxylic acid amides
  • Substituents
  • 2-pyrrolidone
  • carbonyl group
  • lactam
  • azacycle
  • carboxamide group
  • carboxylic acid derivative
  • para-oxazepine
  • aliphatic heteropolycyclic compound
  • oxacycle
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • oxetane
  • organonitrogen compound
  • organopnictogen compound
  • hemiacetal
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • pyrrolidone
  • organooxygen compound