Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:09 UTC
Update Date2025-03-25 00:46:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02153856
Frequency0.5
Structure
Chemical FormulaC4H9O6PS
Molecular Mass215.9857
SMILESCS(=O)CCC(=O)OP(=O)(O)O
InChI KeyLMLYPXFYQDAPNL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic phosphoric acids and derivatives
Subclass phosphate esters
Direct Parent acyl monophosphates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organic phosphoric acids and derivatives
  • sulfinyl compounds
  • sulfoxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • acyl monophosphate
  • organosulfur compound
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • sulfinyl compound
  • sulfoxide
  • hydrocarbon derivative
  • organooxygen compound