Hmdb loader

Showing information for DMID02244697

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:18:58 UTC
Update Date2025-03-25 01:00:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02244697
Frequency0.5
Structure
Chemical FormulaC10H19NO3S
Molecular Mass233.1086
SMILESCCCCC=C(O)C(O)=NCCS(C)=O
InChI KeyPNBJUEMIHXGICN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classsulfoxides
Subclass sulfoxides
Direct Parent sulfoxides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carboximidic acids
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • sulfinyl compounds
    • Substituents
  • aliphatic acyclic compound
  • carboximidic acid
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • organonitrogen compound
  • sulfoxide
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound