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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:48 UTC
Update Date2025-03-25 00:46:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02157566
Frequency0.5
Structure
Chemical FormulaC9H14N2O5
Molecular Mass230.0903
SMILESO=C(O)CCNC(=O)C1CNC(C(=O)O)C1
InChI KeyIGVWXCIOVNMKQN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classpeptidomimetics
Subclass peptidomimetics
Direct Parent peptidomimetics
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acids
  • amino acids
  • azacyclic compounds
  • beta amino acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • proline and derivatives
  • pyrrolidine carboxylic acids
  • pyrrolidinecarboxamides
  • secondary carboxylic acid amides
  • Substituents
  • carbonyl group
  • carboxylic acid
  • amino acid or derivatives
  • amino acid
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • non-alpha peptide
  • organic oxide
  • pyrrolidine carboxylic acid
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • pyrrolidine
  • organoheterocyclic compound
  • proline or derivatives
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • carboxamide group
  • beta amino acid or derivatives
  • secondary carboxylic acid amide
  • pyrrolidine carboxylic acid or derivatives
  • organic oxygen compound
  • pyrrolidine-3-carboxamide
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine