Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:27 UTC
Update Date2025-03-25 00:49:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02172614
Frequency0.5
Structure
Chemical FormulaC10H15NOS
Molecular Mass197.0874
SMILESCCCC(=O)NCCc1cccs1
InChI KeyXBSOPBFKIMIRFU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty amides
Direct Parent n-acyl amines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • thiophenes
  • Substituents
  • carbonyl group
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • thiophene
  • carboxamide group
  • carboxylic acid derivative
  • n-acyl-amine
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound