Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:53 UTC
Update Date2025-03-25 00:47:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02164461
Frequency0.5
Structure
Chemical FormulaC4H9O5PS
Molecular Mass199.9908
SMILESCC(O)(CO[PH](=O)S)C(=O)O
InChI KeyJPZLMBUJUSFMBD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass alpha hydroxy acids and derivatives
Direct Parent alpha hydroxy acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • tertiary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • alpha-hydroxy acid
  • carboxylic acid derivative
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound