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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:07:22 UTC
Update Date2025-03-25 00:56:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02218379
Frequency0.5
Structure
Chemical FormulaC11H16N4O6
Molecular Mass300.107
SMILESCn1[nH]c(=O)c2ncn(CC(O)C(O)C(O)CO)c2c1=O
InChI KeySNQGGTCZHGZHMG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyridazines and derivatives
Direct Parent pyridazinones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • lactams
  • n-substituted imidazoles
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary alcohols
  • secondary alcohols
  • vinylogous amides
  • Substituents
  • alcohol
  • vinylogous amide
  • lactam
  • azacycle
  • heteroaromatic compound
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • pyridazinone
  • organic nitrogen compound
  • primary alcohol
  • organooxygen compound
  • azole
  • n-substituted imidazole