Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:50:54 UTC
Update Date2025-03-24 20:55:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01611455
Frequency0.8
Structure
Chemical FormulaC5H6N2O3
Molecular Mass142.0378
SMILESNC1=C(C(=O)O)CC(=O)N1
InChI KeyZASVOURMMNCMOU-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
  • hydrocarbon derivatives
  • lactams
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • carbonyl group
  • lactam
  • carboxylic acid
  • azacycle
  • carboxamide group
  • carboxylic acid derivative
  • secondary carboxylic acid amide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • pyrroline
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound