Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:27:59 UTC
Update Date2025-03-24 21:11:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01701279
Frequency0.7
Structure
Chemical FormulaC6H12N2O
Molecular Mass128.095
SMILESNC(=O)CCC1CNC1
InChI KeyFRFLSYQZPPXECT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent delta amino acids and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • azetidines
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylamines
  • fatty amides
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • fatty acyl
  • secondary aliphatic amine
  • carbonyl group
  • azacycle
  • fatty amide
  • secondary amine
  • carboxamide group
  • azetidine
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • delta amino acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound
  • amine