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Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:35:55 UTC
Update Date2025-03-21 17:57:08 UTC
HMDB IDHMDB0041912
Metabolite Identification
DeepMet IDDMID00005942
NameIsonicotinylglycine
Frequency903.7
Structure
Chemical FormulaC8H8N2O3
Molecular Mass180.0535
SMILESO=C(O)CNC(=O)c1ccncc1
InChI KeyHKCLSDCBERVTCT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent acyl glycines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyridinecarboxylic acids and derivatives
  • secondary carboxylic acid amides
  • Substituents
  • pyridine carboxylic acid or derivatives
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organoheterocyclic compound
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • carboxamide group
  • n-acylglycine
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • pyridine
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound