Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:58:05 UTC
Update Date2025-03-21 18:05:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00057610
Frequency55.0
Structure
Chemical FormulaC3H8N2O4S
Molecular Mass168.0205
SMILESNS(=O)(=O)NCCC(=O)O
InChI KeyCCTQSPBZRRMJMB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent beta amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfuric acid diamides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • organic sulfuric acid or derivatives
  • beta amino acid or derivatives
  • sulfuric acid diamide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound