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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:51 UTC
Update Date2025-03-21 18:35:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00107544
Frequency25.0
Structure
Chemical FormulaC8H16N2O5
Molecular Mass220.1059
SMILESNCCC(=O)NC1OC(CO)C(O)C1O
InChI KeyOFWQABMJLSFYHD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent beta amino acids and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • secondary alcohols
  • secondary carboxylic acid amides
  • tetrahydrofurans
  • Substituents
  • alcohol
  • carbonyl group
  • tetrahydrofuran
  • monosaccharide
  • carboxamide group
  • beta amino acid or derivatives
  • oxacycle
  • secondary carboxylic acid amide
  • saccharide
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • primary alcohol
  • organoheterocyclic compound
  • organooxygen compound