Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:24:35 UTC
Update Date2025-03-21 18:38:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00121382
Frequency21.4
Structure
Chemical FormulaC9H9F2NO3
Molecular Mass217.055
SMILESO=C(CO)Nc1ccccc1OC(F)F
InChI KeyVRTZKWPCXIMURT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass anilides
Direct Parent anilides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • alkyl fluorides
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • n-arylamides
  • organic oxides
  • organofluorides
  • organopnictogen compounds
  • phenol ethers
  • phenoxy compounds
  • secondary carboxylic acid amides
  • Substituents
  • alcohol
  • phenol ether
  • carbonyl group
  • alkyl fluoride
  • organofluoride
  • n-arylamide
  • carboxamide group
  • carboxylic acid derivative
  • organohalogen compound
  • aromatic homomonocyclic compound
  • anilide
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • alkyl halide
  • hydrocarbon derivative
  • organic nitrogen compound
  • phenoxy compound
  • organooxygen compound