Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:17:51 UTC
Update Date2025-03-21 18:35:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00105086
Frequency25.7
Structure
Chemical FormulaC5H5FO6
Molecular Mass180.007
SMILESO=C(O)CC(F)(C(=O)O)C(=O)O
InChI KeyZCPBSWZTITUKTJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass tricarboxylic acids and derivatives
Direct Parent tricarboxylic acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl fluorides
  • alpha-halocarboxylic acids
  • carbonyl compounds
  • carboxylic acids
  • fatty acyls
  • halogenated fatty acids
  • hydrocarbon derivatives
  • organic oxides
  • organofluorides
  • Substituents
  • halogenated fatty acid
  • alpha-halocarboxylic acid or derivatives
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • alkyl fluoride
  • organofluoride
  • tricarboxylic acid or derivatives
  • alpha-halocarboxylic acid
  • organohalogen compound
  • organic oxide
  • organic oxygen compound
  • alkyl halide
  • hydrocarbon derivative
  • organooxygen compound