Hmdb loader

Showing information for DMID02222635

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:12 UTC
Update Date2025-03-25 00:57:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02222635
Frequency0.5
Structure
Chemical FormulaC13H5F15O3S
Molecular Mass525.972
SMILESO=S(=O)(Oc1ccccc1)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChI KeyZKCHXVNJULWUKU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenoxy compounds
Direct Parent phenoxy compounds
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl fluorides
  • hydrocarbon derivatives
  • organic oxides
  • organofluorides
  • organooxygen compounds
  • organosulfonic acid esters
  • sulfonic acid esters
  • sulfonyls
    • Substituents
  • organosulfonic acid or derivatives
  • alkyl fluoride
  • organofluoride
  • organosulfur compound
  • organohalogen compound
  • organosulfonic acid ester
  • aromatic homomonocyclic compound
  • sulfonic acid ester
  • organic oxide
  • sulfonyl
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • alkyl halide
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound