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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:07 UTC
Update Date2025-03-25 00:45:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02151391
Frequency0.5
Structure
Chemical FormulaC11H16N4O5
Molecular Mass284.1121
SMILESCn1c(=O)[nH]c(N2CCOCC2)c(NC(=O)CO)c1=O
InChI KeyXZLSFWWIRHGZME-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass n-arylamides
Direct Parent n-arylamides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • aminopyrimidines and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkyl ethers
  • dialkylarylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • morpholines
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • pyrimidones
  • secondary carboxylic acid amides
  • vinylogous amides
  • Substituents
  • carbonyl group
  • ether
  • lactam
  • aromatic heteromonocyclic compound
  • pyrimidone
  • n-arylamide
  • carboxylic acid derivative
  • dialkyl ether
  • pyrimidine
  • organic oxide
  • organopnictogen compound
  • dialkylarylamine
  • organoheterocyclic compound
  • alcohol
  • vinylogous amide
  • carbonic acid derivative
  • azacycle
  • heteroaromatic compound
  • carboxamide group
  • oxazinane
  • aminopyrimidine
  • oxacycle
  • secondary carboxylic acid amide
  • morpholine
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound