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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:53 UTC
Update Date2025-03-25 00:51:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02189684
Frequency0.5
Structure
Chemical FormulaC14H23NO2S
Molecular Mass269.145
SMILESCC(C)CN(Cc1ccccc1)S(=O)(=O)C(C)C
InChI KeyBMADOGXYSYJHDW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aminosulfonyl compounds
  • hydrocarbon derivatives
  • organic oxides
  • organic sulfonamides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfonamides
  • Substituents
  • organosulfonic acid or derivatives
  • monocyclic benzene moiety
  • aminosulfonyl compound
  • organosulfur compound
  • organosulfonic acid amide
  • aromatic homomonocyclic compound
  • organic oxide
  • sulfonyl
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic sulfonic acid amide