Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:49:57 UTC
Update Date2025-03-25 01:12:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02315861
Frequency0.5
Structure
Chemical FormulaC6H11NS
Molecular Mass129.0612
SMILESC1CC2CNC2CS1
InChI KeyWWGYVRVPDKLIAJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthianes
Subclass thianes
Direct Parent thianes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • azetidines
  • dialkylamines
  • dialkylthioethers
  • hydrocarbon derivatives
  • organopnictogen compounds
  • Substituents
  • secondary aliphatic amine
  • azacycle
  • dialkylthioether
  • secondary amine
  • azetidine
  • aliphatic heteropolycyclic compound
  • thioether
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • thiane