Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:27:01 UTC
Update Date2025-03-21 19:17:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00266626
Frequency7.7
Structure
Chemical FormulaC6H9NOS
Molecular Mass143.0405
SMILESNCCc1ccc(O)s1
InChI KeyGJUBUPFICIHMFK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiophenes
Subclass 2,5-disubstituted thiophenes
Direct Parent 2,5-disubstituted thiophenes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • 2,5-disubstituted thiophene
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound