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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:42 UTC
Update Date2025-03-25 00:54:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02205144
Frequency0.5
Structure
Chemical FormulaC7H12N2O4
Molecular Mass188.0797
SMILESNC1CC(O)=NC(C(O)C(=O)O)C1
InChI KeyJVXCJRHUCWQFBL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent delta amino acids and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha hydroxy acids and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • cyclic carboximidic acids
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
  • tetrahydropyridines
  • Substituents
  • carbonyl group
  • carboxylic acid
  • alpha-hydroxy acid
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • delta amino acid or derivatives
  • organoheterocyclic compound
  • alcohol
  • azacycle
  • tetrahydropyridine
  • organic 1,3-dipolar compound
  • hydroxy acid
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • cyclic carboximidic acid
  • organooxygen compound