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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:20 UTC
Update Date2025-03-21 18:35:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00106246
Frequency25.4
Structure
Chemical FormulaC10H11NO4
Molecular Mass209.0688
SMILESCOC(=O)c1cc(OC)ccc1NC=O
InChI KeyQZNGEPCCLQDSKP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzoic acids and derivatives
Direct Parent acylaminobenzoic acid and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anilides
  • anisoles
  • benzoic acid esters
  • benzoyl derivatives
  • carbonyl compounds
  • hydrocarbon derivatives
  • m-methoxybenzoic acids and derivatives
  • methoxybenzenes
  • methyl esters
  • monocarboxylic acids and derivatives
  • n-arylamides
  • organic oxides
  • organopnictogen compounds
  • phenoxy compounds
  • secondary carboxylic acid amides
  • vinylogous amides
    • Substituents
  • phenol ether
  • carbonyl group
  • ether
  • benzoyl
  • n-arylamide
  • benzoate ester
  • alkyl aryl ether
  • carboxylic acid derivative
  • organic oxide
  • methyl ester
  • organonitrogen compound
  • organopnictogen compound
  • m-methoxybenzoic acid or derivatives
  • vinylogous amide
  • acylaminobenzoic acid or derivatives
  • carboxamide group
  • methoxybenzene
  • aromatic homomonocyclic compound
  • anilide
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • anisole
  • carboxylic acid ester
  • hydrocarbon derivative
  • organic nitrogen compound
  • phenoxy compound
  • organooxygen compound