Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:35:53 UTC
Update Date2025-03-21 17:57:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00005856
Frequency898.1
Structure
Chemical FormulaC6H9NS
Molecular Mass127.0456
SMILESNCCc1cccs1
InChI KeyHVLUYXIJZLDNIS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classheteroaromatic compounds
Subclass heteroaromatic compounds
Direct Parent heteroaromatic compounds
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • thiophenes
  • Substituents
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • thiophene