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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:12 UTC
Update Date2025-03-25 00:50:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02181291
Frequency0.5
Structure
Chemical FormulaC10H14N2O6
Molecular Mass258.0852
SMILESO=C(O)CN=C(O)CCC1CC(C(=O)O)N=C1O
InChI KeyCQCDPZGAZLFZKI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • cyclic carboximidic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • pyrroline 2-carboxylic acids
  • Substituents
  • carboximidic acid
  • carbonyl group
  • carboxylic acid
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organoheterocyclic compound
  • azacycle
  • pyrroline carboxylic acid or derivatives
  • organic 1,3-dipolar compound
  • pyrroline 2-carboxylic acid
  • pyrroline
  • organic oxygen compound
  • pyrroline carboxylic acid
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • cyclic carboximidic acid
  • organooxygen compound