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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:23:39 UTC
Update Date2025-03-21 18:38:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00119202
Frequency31.6
Structure
Chemical FormulaC15H16N4O3
Molecular Mass300.1222
SMILESO=C1NC(Cc2cnc[nH]2)C(=O)NC1Cc1ccc(O)cc1
InChI KeyJTUCKVICLZLKIS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 2,5-dioxopiperazines
  • azacyclic compounds
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • lactam
  • aromatic heteromonocyclic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • 2,5-dioxopiperazine
  • organic oxide
  • dioxopiperazine
  • piperazine
  • imidazole
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organoheterocyclic compound
  • azole
  • azacycle
  • heteroaromatic compound
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxygen compound
  • 1,4-diazinane
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound