Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:39:41 UTC
Update Date2025-03-24 21:43:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01871524
Frequency0.6
Structure
Chemical FormulaC4H9NO2S
Molecular Mass135.0354
SMILESCOC(=O)NCCS
InChI KeyTWMXAGZGOYZGSF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent methylcarbamates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carbonic acid derivative
  • methylcarbamate
  • organosulfur compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • alkylthiol
  • organooxygen compound