Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:44:59 UTC
Update Date2025-03-24 14:02:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00734616
Frequency2.1
Structure
Chemical FormulaC6H9NOS
Molecular Mass143.0405
SMILESO=C1CCC2CSCN12
InChI KeyJFKGWSGAHWOQAU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolothiazoles
Subclass pyrrolothiazoles
Direct Parent pyrrolothiazoles
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylthioethers
  • hydrocarbon derivatives
  • lactams
  • n-alkylpyrrolidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • pyrrolidine-2-ones
  • tertiary carboxylic acid amides
  • thiazolidines
  • thiohemiaminal derivatives
  • Substituents
  • 2-pyrrolidone
  • carbonyl group
  • lactam
  • carboxylic acid derivative
  • aliphatic heteropolycyclic compound
  • organic oxide
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • hemithioaminal
  • organopnictogen compound
  • pyrrolidine
  • pyrrolidone
  • azacycle
  • n-alkylpyrrolidine
  • pyrrolothiazole
  • dialkylthioether
  • carboxamide group
  • organic oxygen compound
  • thioether
  • pyrrole
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • thiazolidine