Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:33:56 UTC
Update Date2025-03-21 17:56:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00001313
Frequency4419.1
Structure
Chemical FormulaC6H9NO6
Molecular Mass191.043
SMILESO=C(O)CNC(CC(=O)O)C(=O)O
InChI KeyBTLHODXEDLCLAD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent aspartic acid and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha amino acids
  • amino acids
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • tricarboxylic acids and derivatives
  • Substituents
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • carbonyl group
  • carboxylic acid
  • amino acid
  • tricarboxylic acid or derivatives
  • secondary amine
  • organic oxide
  • organic oxygen compound
  • aspartic acid or derivatives
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine