Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:41 UTC
Update Date2025-03-21 18:40:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00131100
Frequency19.3
Structure
Chemical FormulaC12H21N3O3
Molecular Mass255.1583
SMILESCC(=O)NCCC(=O)NCCCN1CCCC1=O
InChI KeyFOXQWJADMDNKBC-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
  • acetamides
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • lactams
  • n-alkylpyrrolidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolidine-2-ones
  • secondary carboxylic acid amides
  • tertiary carboxylic acid amides
  • Substituents
  • 2-pyrrolidone
  • carbonyl group
  • lactam
  • azacycle
  • n-alkylpyrrolidine
  • carboxamide group
  • beta amino acid or derivatives
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • pyrrolidone
  • organoheterocyclic compound
  • acetamide
  • organooxygen compound