Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:40 UTC
Update Date2025-03-25 00:46:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02157272
Frequency0.5
Structure
Chemical FormulaC4H8N2O2
Molecular Mass116.0586
SMILESO=C1CNCC(O)N1
InChI KeySMNWOVXJRZKRRY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkanolamines
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylamines
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organopnictogen compounds
  • piperazines
  • secondary carboxylic acid amides
  • Substituents
  • carbonyl group
  • lactam
  • organic oxide
  • piperazine
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organoheterocyclic compound
  • alkanolamine
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxygen compound
  • 1,4-diazinane
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine