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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:45:08 UTC
Update Date2025-03-21 18:49:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00169680
Frequency13.8
Structure
Chemical FormulaC7H11NS
Molecular Mass141.0612
SMILESCc1ccc(CCN)s1
InChI KeyVAYWLNRNWZOIAG-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
  • organopnictogen compounds
    • Substituents
  • 2,5-disubstituted thiophene
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound