Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:35:40 UTC
Update Date2025-03-24 22:08:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02004182
Frequency0.6
Structure
Chemical FormulaC4H9NOS
Molecular Mass119.0405
SMILESCN1CCCS1=O
InChI KeyDQXRSLXXCRMPKR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classsulfinic acids and derivatives
Subclass sulfinic acids and derivatives
Direct Parent sulfinic acids and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfinyl compounds
  • Substituents
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • azacycle
  • sulfinic acid derivative
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound