Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:18:05 UTC
Update Date2025-03-25 01:00:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02242587
Frequency0.5
Structure
Chemical FormulaC10H9F3O
Molecular Mass202.0606
SMILESCC(=O)Cc1cccc(C(F)(F)F)c1
InChI KeyJPHQCDCEBDRIOL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass trifluoromethylbenzenes
Direct Parent trifluoromethylbenzenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl fluorides
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • organofluorides
  • phenylpropanes
  • Substituents
  • carbonyl group
  • alkyl fluoride
  • organofluoride
  • organohalogen compound
  • ketone
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • alkyl halide
  • hydrocarbon derivative
  • trifluoromethylbenzene
  • organooxygen compound