Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:48:56 UTC
Update Date2025-03-24 14:35:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00887884
Frequency1.6
Structure
Chemical FormulaC4H5NO2S
Molecular Mass131.0041
SMILESO=C(O)C1=CCSN1
InChI KeyGWFKXVIXNORBKK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfenic acid amides
  • thiazolines
  • Substituents
  • carbonyl group
  • organosulfenic acid amide
  • carboxylic acid
  • azacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • ortho-thiazoline
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound