Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:55 UTC
Update Date2025-03-21 18:35:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00107719
Frequency24.9
Structure
Chemical FormulaC6H9NOS
Molecular Mass143.0405
SMILESNCC(O)c1cccs1
InChI KeyLOULKRKJFMPTJQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classheteroaromatic compounds
Subclass heteroaromatic compounds
Direct Parent heteroaromatic compounds
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • thiophenes
  • Substituents
  • aromatic alcohol
  • alcohol
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • thiophene
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound