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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:46 UTC
Update Date2025-03-25 00:57:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02223939
Frequency0.5
Structure
Chemical FormulaC7H10N3O5P
Molecular Mass247.0358
SMILESNC(=O)c1cc(N)c(COP(=O)(O)O)cn1
InChI KeyGVLLFZZSBDBELY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass pyridinecarboxylic acids and derivatives
Direct Parent pyridinecarboxylic acids and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • 2-heteroaryl carboxamides
  • amino acids and derivatives
  • azacyclic compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • monoalkyl phosphates
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • primary amines
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • pyridine carboxylic acid or derivatives
  • aromatic heteromonocyclic compound
  • amino acid or derivatives
  • polyhalopyridine
  • carboxylic acid derivative
  • 2-heteroaryl carboxamide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • carboxamide group
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • amine
  • alkyl phosphate
  • organooxygen compound