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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:28 UTC
Update Date2025-03-25 00:48:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02168090
Frequency0.5
Structure
Chemical FormulaC9H20N2O2
Molecular Mass188.1525
SMILESCC(N)C(=O)N(C)C(CO)C(C)C
InChI KeyAWAVDAISRLLMNV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acid amides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alanine and derivatives
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary alcohols
  • tertiary carboxylic acid amides
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • alpha-amino acid amide
  • carboxamide group
  • organic oxide
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • alanine or derivatives
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • primary alcohol
  • organooxygen compound