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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:02:22 UTC
Update Date2025-03-25 00:54:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02206652
Frequency0.5
Structure
Chemical FormulaC11H10N2O6
Molecular Mass266.0539
SMILESO=C(O)C(O)Cn1cnc2cc(O)c(O)cc2c1=O
InChI KeyPGPCDBCPDAVVAW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazanaphthalenes
Subclass benzodiazines
Direct Parent quinazolines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alpha hydroxy acids and derivatives
  • azacyclic compounds
  • benzenoids
  • carbonyl compounds
  • carboxylic acids
  • diazanaphthalenes
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrimidones
  • secondary alcohols
  • Substituents
  • carbonyl group
  • lactam
  • carboxylic acid
  • alpha-hydroxy acid
  • 1-hydroxy-2-unsubstituted benzenoid
  • pyrimidone
  • carboxylic acid derivative
  • pyrimidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • alcohol
  • azacycle
  • heteroaromatic compound
  • hydroxy acid
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • quinazoline
  • organooxygen compound