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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:17:28 UTC
Update Date2025-03-25 01:00:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02241182
Frequency0.5
Structure
Chemical FormulaC15H23N3O2S
Molecular Mass309.1511
SMILESCC(=O)NCCCCCCNC(=S)Nc1ccc(O)cc1
InChI KeyYYJKBJSNRKFBCL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass n-phenylthioureas
Direct Parent n-phenylthioureas
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • acetamides
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • thioureas
  • Substituents
  • carbonyl group
  • thiourea
  • n-phenylthiourea
  • 1-hydroxy-2-unsubstituted benzenoid
  • organosulfur compound
  • carboxamide group
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • organic nitrogen compound
  • acetamide
  • organooxygen compound