Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:59:01 UTC
Update Date2025-03-21 18:54:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00201944
Frequency11.0
Structure
Chemical FormulaC7H8N2O
Molecular Mass136.0637
SMILESNc1ccc(NC=O)cc1
InChI KeyMUQQKIMNQFFGRV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass anilides
Direct Parent anilides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • amino acids and derivatives
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • n-arylamides
  • organic oxides
  • organopnictogen compounds
  • primary amines
  • secondary carboxylic acid amides
  • Substituents
  • carbonyl group
  • amino acid or derivatives
  • n-arylamide
  • carboxamide group
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • anilide
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound