Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:18:05 UTC
Update Date2025-03-25 00:10:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01247539
Frequency1.1
Structure
Chemical FormulaC4H7NO2
Molecular Mass101.0477
SMILESOC(O)C1CC=N1
InChI KeyFFDONJPQESQTRW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazacyclic compounds
Subclass azacyclic compounds
Direct Parent azacyclic compounds
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl hydrates
  • hydrocarbon derivatives
  • imines
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • carbonyl hydrate
  • azacycle
  • imine
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound