Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:16:33 UTC
Update Date2025-03-21 18:34:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00101873
Frequency26.8
Structure
Chemical FormulaC10H11F3O
Molecular Mass204.0762
SMILESCC(C)(c1ccc(O)cc1)C(F)(F)F
InChI KeyZKXRVUUNYLRERR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkyl fluorides
  • hydrocarbon derivatives
  • organofluorides
  • organooxygen compounds
  • Substituents
  • alkyl fluoride
  • organofluoride
  • 1-hydroxy-2-unsubstituted benzenoid
  • organohalogen compound
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • phenol
  • alkyl halide
  • hydrocarbon derivative
  • organooxygen compound