Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:11:25 UTC
Update Date2025-03-24 21:57:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01946216
Frequency0.6
Structure
Chemical FormulaC4H7NO2S
Molecular Mass133.0197
SMILESCNC(=S)OC(C)=O
InChI KeyOEGIOYAKRWHJHX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass monocarboxylic acids and derivatives
Direct Parent monocarboxylic acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organosulfur compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound