Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:04:12 UTC
Update Date2025-03-25 00:55:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02211012
Frequency0.5
Structure
Chemical FormulaC7H7N3O4
Molecular Mass197.0437
SMILESCC(=O)NC1=C(NC=O)NC(=O)C1=O
InChI KeyMYASKZAPCBRXNV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolines
Subclass pyrrolines
Direct Parent pyrrolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetamides
  • azacyclic compounds
  • carboxylic acids and derivatives
  • cyclic ketones
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • carbonyl group
  • lactam
  • azacycle
  • cyclic ketone
  • carboxamide group
  • carboxylic acid derivative
  • ketone
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • pyrroline
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • acetamide
  • organooxygen compound