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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:10:56 UTC
Update Date2025-03-25 00:57:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02226486
Frequency0.5
Structure
Chemical FormulaC8H14N2O2
Molecular Mass170.1055
SMILESCC(N=C1CCCN1C)C(=O)O
InChI KeyONPYPMARAFUTLI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alanine and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acids
  • amidines
  • azacyclic compounds
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids
  • hydrocarbon derivatives
  • imidolactams
  • monocarboxylic acids and derivatives
  • n-alkylpyrrolidines
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • carbonyl group
  • carboxylic acid
  • amidine
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • pyrrolidine
  • imidolactam
  • organoheterocyclic compound
  • azacycle
  • n-alkylpyrrolidine
  • organic 1,3-dipolar compound
  • carboximidamide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • alanine or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound