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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:57 UTC
Update Date2025-03-25 01:01:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02251591
Frequency0.5
Structure
Chemical FormulaC13H17NO6
Molecular Mass283.1056
SMILESO=CNc1ccccc1C1OC(CO)C(O)C(O)C1O
InChI KeyDVTGOUKEBRFCQP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass anilides
Direct Parent anilides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkyl ethers
  • hydrocarbon derivatives
  • monosaccharides
  • n-arylamides
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
  • secondary carboxylic acid amides
    • Substituents
  • carbonyl group
  • ether
  • aromatic heteromonocyclic compound
  • monosaccharide
  • n-arylamide
  • carboxylic acid derivative
  • dialkyl ether
  • saccharide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • carboxamide group
  • anilide
  • oxacycle
  • secondary carboxylic acid amide
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound