Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:52:52 UTC
Update Date2025-03-25 01:13:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02322451
Frequency0.5
Structure
Chemical FormulaC3H9NOS2
Molecular Mass139.0126
SMILESNC(S)C(O)CS
InChI KeyCAGFIHHTXDBQCC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • thiohemiaminal derivatives
  • Substituents
  • aliphatic acyclic compound
  • organosulfur compound
  • organonitrogen compound
  • secondary alcohol
  • hemithioaminal
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • alkylthiol