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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:21:13 UTC
Update Date2025-03-21 18:36:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00113281
Frequency23.4
Structure
Chemical FormulaC10H14N6O2
Molecular Mass250.1178
SMILESNc1ncnc2c1ncn2CCCC(N)C(=O)O
InChI KeySEGLQDHIEXCIKN-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 heteropolycyclic compounds
Alternative Parents
  • amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • n-substituted imidazoles
  • organic oxides
  • organopnictogen compounds
  • purines and purine derivatives
  • pyrimidines and pyrimidine derivatives
  • Substituents
  • carbonyl group
  • carboxylic acid
  • amino acid
  • imidazopyrimidine
  • pyrimidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • imidolactam
  • organoheterocyclic compound
  • azole
  • n-substituted imidazole
  • azacycle
  • heteroaromatic compound
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • primary amine
  • purine
  • organic nitrogen compound
  • amine
  • organooxygen compound