Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:17 UTC
Update Date2025-03-25 00:51:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02185971
Frequency0.5
Structure
Chemical FormulaC10H13NO5S
Molecular Mass259.0514
SMILESO=C(CO)Nc1ccccc1S(=O)(=O)CCO
InChI KeyZMKMBJOHWPBULL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass anilides
Direct Parent anilides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • benzenesulfonyl compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • n-arylamides
  • organic oxides
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • sulfones
  • Substituents
  • alcohol
  • carbonyl group
  • n-arylamide
  • organosulfur compound
  • carboxamide group
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • anilide
  • secondary carboxylic acid amide
  • organic oxide
  • sulfonyl
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • sulfone
  • benzenesulfonyl group