Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:58:31 UTC
Update Date2025-03-21 23:01:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00623792
Frequency2.6
Structure
Chemical FormulaC6H9NOS+
Molecular Mass143.0399
SMILESCC1=C(CCO)SC=[N+]1
InChI KeyJBRRMJUUUIUWQS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazacyclic compounds
Subclass azacyclic compounds
Direct Parent azacyclic compounds
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • hydrocarbon derivatives
  • organic cations
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • alcohol
  • organic oxygen compound
  • azacycle
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organooxygen compound