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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:02 UTC
Update Date2025-03-25 00:47:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02160254
Frequency0.5
Structure
Chemical FormulaC10H16N6O3
Molecular Mass268.1284
SMILESNc1nc(=O)c2c([nH]1)N(CCC(N)C(=O)O)CCN2
InChI KeyFPNCMDADCCYFIY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpteridines and derivatives
Subclass pterins and derivatives
Direct Parent pterins and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alpha amino acids
  • amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dialkylarylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • pyrimidones
  • secondary alkylarylamines
  • vinylogous amides
  • Substituents
  • carbonyl group
  • carboxylic acid
  • amino acid or derivatives
  • amino acid
  • pyrimidone
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • pyrimidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • dialkylarylamine
  • vinylogous amide
  • pterin
  • azacycle
  • heteroaromatic compound
  • secondary amine
  • secondary aliphatic/aromatic amine
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound