Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:22:25 UTC
Update Date2025-03-21 19:12:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00256305
Frequency8.1
Structure
Chemical FormulaC7H9NO2
Molecular Mass139.0633
SMILESCc1ccc(CC(N)=O)o1
InChI KeyALYNPGNJIXWHAY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurans
Subclass furans
Direct Parent furans
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • furan
  • carbonyl group
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • carboxamide group
  • carboxylic acid derivative
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound