Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:02:02 UTC
Update Date2025-03-25 00:54:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02205884
Frequency0.5
Structure
Chemical FormulaC9H14N2O2S2
Molecular Mass246.0497
SMILESNC(=S)NCCSCc1ccc(CO)o1
InChI KeyRFSLHSQPJAGLTE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurans
Subclass furans
Direct Parent furans
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • dialkylthioethers
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • sulfenyl compounds
  • thioureas
  • Substituents
  • aromatic alcohol
  • alcohol
  • furan
  • thiourea
  • sulfenyl compound
  • aromatic heteromonocyclic compound
  • dialkylthioether
  • heteroaromatic compound
  • organosulfur compound
  • oxacycle
  • organic oxygen compound
  • thioether
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound