Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:05:33 UTC
Update Date2025-03-24 20:09:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01360450
Frequency1.0
Structure
Chemical FormulaC3HF3O3
Molecular Mass141.9878
SMILESO=C(O)C(F)(F)C(=O)F
InChI KeyGMWJQQFADUSJQE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass alpha-halocarboxylic acids and derivatives
Direct Parent alpha-halocarboxylic acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acyl fluorides
  • alkyl fluorides
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organofluorides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • alkyl fluoride
  • organofluoride
  • acyl fluoride
  • alpha-halocarboxylic acid
  • organohalogen compound
  • acyl halide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • alkyl halide
  • hydrocarbon derivative
  • organooxygen compound