Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:57 UTC
Update Date2025-03-25 00:47:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02162333
Frequency0.5
Structure
Chemical FormulaC14H17N3O8
Molecular Mass355.1016
SMILESO=C(O)CCC(NN=CC=C1C=C(C(=O)O)NC(C(=O)O)C1)C(=O)O
InChI KeyGNUPJVBZRFPCLD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent glutamic acid and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acids
  • amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • hydrazones
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • tetracarboxylic acids and derivatives
  • tetrahydropyridines
  • Substituents
  • carbonyl group
  • carboxylic acid
  • amino acid
  • hydrazone
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organoheterocyclic compound
  • secondary aliphatic amine
  • azacycle
  • tetrahydropyridine
  • tetracarboxylic acid or derivatives
  • glutamic acid or derivatives
  • secondary amine
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine