Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:41:27 UTC
Update Date2025-03-25 01:32:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02435565
Frequency0.5
Structure
Chemical FormulaC6H7NO3
Molecular Mass141.0426
SMILESCN(C)c1c(O)c(=O)c1=O
InChI KeyOOCVIQONYQGULG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent dialkylarylamines
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • vinylogous acids
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • cyclic ketone
  • aromatic homomonocyclic compound
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • dialkylarylamine
  • organooxygen compound