Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:52:33 UTC
Update Date2025-03-25 00:51:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02184285
Frequency0.5
Structure
Chemical FormulaC8H14N2O4
Molecular Mass202.0954
SMILESNC(CC(=O)O)C(O)C1CC(O)C=N1
InChI KeyGDAMBNLSCJQFJS-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
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heterocyclic fatty acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • imines
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • pyrrolines
  • secondary alcohols
  • short-chain hydroxy acids and derivatives
  • Substituents
  • fatty acyl
  • carbonyl group
  • carboxylic acid
  • short-chain hydroxy acid
  • heterocyclic fatty acid
  • imine
  • fatty acid
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydroxy fatty acid
  • organoheterocyclic compound
  • alcohol
  • azacycle
  • organic 1,3-dipolar compound
  • beta amino acid or derivatives
  • monocarboxylic acid or derivatives
  • pyrroline
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound