Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:47 UTC
Update Date2025-03-25 00:46:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02152959
Frequency0.5
Structure
Chemical FormulaC9H12N2OS
Molecular Mass196.067
SMILESC=CCNC(=S)NCc1ccco1
InChI KeyWHBFUJAOSAQUHQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurans
Subclass furans
Direct Parent furans
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • thioureas
  • Substituents
  • furan
  • thiourea
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • organosulfur compound
  • oxacycle
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound