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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:11 UTC
Update Date2025-03-25 00:51:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02188065
Frequency0.5
Structure
Chemical FormulaC17H25N3O4
Molecular Mass335.1845
SMILESCC(=O)Nc1ccc(C(=O)N2CCN(CCOCCO)CC2)cc1
InChI KeyTUFDPHDRBZWALT-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 heteromonocyclic compounds
Alternative Parents
  • acetamides
  • acetanilides
  • alcohols and polyols
  • amino acids and derivatives
  • azacyclic compounds
  • benzamides
  • benzoyl derivatives
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkyl ethers
  • hydrocarbon derivatives
  • n-acetylarylamines
  • n-alkylpiperazines
  • organic oxides
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • tertiary carboxylic acid amides
  • trialkylamines
  • Substituents
  • carbonyl group
  • ether
  • n-acetylarylamine
  • aromatic heteromonocyclic compound
  • amino acid or derivatives
  • benzoyl
  • n-arylamide
  • carboxylic acid derivative
  • dialkyl ether
  • benzamide
  • organic oxide
  • piperazine
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • tertiary amine
  • organoheterocyclic compound
  • acetamide
  • alcohol
  • acylaminobenzoic acid or derivatives
  • azacycle
  • acetanilide
  • n-alkylpiperazine
  • tertiary aliphatic amine
  • carboxamide group
  • anilide
  • secondary carboxylic acid amide
  • organic oxygen compound
  • 1,4-diazinane
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound