Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:13:51 UTC
Update Date2025-03-21 18:33:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00095244
Frequency29.1
Structure
Chemical FormulaC8H9NO2
Molecular Mass151.0633
SMILESNC(=O)COc1ccccc1
InChI KeyAOPRXJXHLWYPQR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass phenol ethers
Direct Parent phenol ethers
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • phenoxy compounds
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • phenol ether
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • alkyl aryl ether
  • carboxamide group
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • phenoxy compound
  • organooxygen compound