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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:57:44 UTC
Update Date2025-03-24 21:51:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01914104
Frequency0.6
Structure
Chemical FormulaC4H13NO2S
Molecular Mass139.0667
SMILESC[SH](=O)(O)CCCN
InChI KeyHICHHYBHVUVBKY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiols
Subclass alkylthiols
Direct Parent alkylthiols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
    • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • alkylthiol