Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:17:59 UTC
Update Date2025-03-21 18:35:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00105391
Frequency25.6
Structure
Chemical FormulaC9H10N2O2
Molecular Mass178.0742
SMILESCN1C(=O)COC1c1cccnc1
InChI KeyWOMUVFHBSYHCNR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass methylpyridines
Direct Parent methylpyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxazolidinones
  • tertiary carboxylic acid amides
  • Substituents
  • carbonyl group
  • lactam
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • methylpyridine
  • carboxamide group
  • carboxylic acid derivative
  • oxacycle
  • oxazolidinone
  • organic oxide
  • organic oxygen compound
  • oxazolidine
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound