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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:13:14 UTC
Update Date2025-03-24 16:43:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00946008
Frequency1.5
Structure
Chemical FormulaC5H7NOS
Molecular Mass129.0248
SMILESCC(=O)C1=CSCN1
InChI KeyOHUVLCVQVDDHHE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classvinylogous thioesters
Subclass vinylogous thioesters
Direct Parent vinylogous thioesters
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • organopnictogen compounds
  • thiazolines
  • thioenol ethers
  • thiohemiaminal derivatives
    • Substituents
  • vinylogous thioester
  • secondary aliphatic amine
  • carbonyl group
  • meta-thiazoline
  • azacycle
  • secondary amine
  • ketone
  • organic oxide
  • thioenolether
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • hemithioaminal
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound
  • amine