Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:15:52 UTC
Update Date2025-03-21 18:34:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00100170
Frequency27.4
Structure
Chemical FormulaC7H6F2O2
Molecular Mass160.0336
SMILESOc1ccccc1OC(F)F
InChI KeyPVNTURWWDZNXTK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass phenol ethers
Direct Parent phenol ethers
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • alkyl fluorides
  • hydrocarbon derivatives
  • organofluorides
  • organooxygen compounds
  • phenoxy compounds
  • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • alkyl fluoride
  • organofluoride
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • organohalogen compound
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • phenol
  • alkyl halide
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound