Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:02:39 UTC
Update Date2025-03-25 00:54:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02207296
Frequency0.5
Structure
Chemical FormulaC12H14N6O7
Molecular Mass354.0924
SMILESNc1nc2c(c(=O)nc(NC=O)n2C2OC(CO)C(O)C2O)c(=O)[nH]1
InChI KeyQYQQZEGZLHNSHC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass n-arylamides
Direct Parent n-arylamides
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • amino acids and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • monosaccharides
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • primary amines
  • pyrimidones
  • secondary alcohols
  • secondary carboxylic acid amides
  • tetrahydrofurans
  • vinylogous amides
  • Substituents
  • carbonyl group
  • lactam
  • amino acid or derivatives
  • monosaccharide
  • pyrimidone
  • n-arylamide
  • carboxylic acid derivative
  • pyrimidine
  • saccharide
  • organic oxide
  • aromatic heteropolycyclic compound
  • organopnictogen compound
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • vinylogous amide
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • carboxamide group
  • oxacycle
  • secondary carboxylic acid amide
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • primary amine
  • amine
  • organooxygen compound