Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:16:05 UTC
Update Date2025-03-25 00:59:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02238014
Frequency0.5
Structure
Chemical FormulaC8H11NO6
Molecular Mass217.0586
SMILESO=C(O)C=NC(CCC(=O)O)CC(=O)O
InChI KeyQHLQBKYLLUUXNP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent gamma amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldimines
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • tricarboxylic acids and derivatives
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • gamma amino acid or derivatives
  • imine
  • tricarboxylic acid or derivatives
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • aldimine
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound