Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:52:01 UTC
Update Date2025-03-25 00:50:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02183092
Frequency0.5
Structure
Chemical FormulaC5H9NO3S
Molecular Mass163.0303
SMILESO=S1(=O)OCC2CCCN21
InChI KeyWFFHPXGNIIMFHE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic sulfuric acids and derivatives
Subclass organic sulfuric acids and derivatives
Direct Parent organic sulfuric acids and derivatives
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxathiazolidines
  • pyrrolidines
  • Substituents
  • organic sulfuric acid or derivatives
  • azacycle
  • 1,2,3-oxathiazolidine
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • organoheterocyclic compound
  • organooxygen compound