Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:59:53 UTC
Update Date2025-03-24 14:09:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00770223
Frequency2.0
Structure
Chemical FormulaC5H11FO3
Molecular Mass138.0692
SMILESCC(O)(CO)C(F)CO
InChI KeyKMMBVUBMVZIDKJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl fluorides
  • fluorohydrins
  • hydrocarbon derivatives
  • organofluorides
  • primary alcohols
  • Substituents
  • aliphatic acyclic compound
  • halohydrin
  • alkyl fluoride
  • organofluoride
  • fluorohydrin
  • organohalogen compound
  • tertiary alcohol
  • alkyl halide
  • hydrocarbon derivative
  • primary alcohol