Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:53:26 UTC
Update Date2025-03-25 00:29:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02046482
Frequency0.6
Structure
Chemical FormulaC5H7NO2
Molecular Mass113.0477
SMILESCC1=CC(=O)N(O)C1
InChI KeyBLQPINUOIQWKRT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolines
Subclass pyrrolines
Direct Parent pyrrolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • hydroxamic acids
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • azacycle
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • pyrroline
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • hydroxamic acid
  • organooxygen compound