Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:40 UTC
Update Date2025-03-25 00:53:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02198161
Frequency0.5
Structure
Chemical FormulaC10H15NO8
Molecular Mass277.0798
SMILESCC(O)(CC(=O)O)C(=O)NC(CCC(=O)O)C(=O)O
InChI KeyVPCSVZGBPBMFPB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent glutamic acid and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • n-acyl amines
  • n-acyl-alpha amino acids
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • tertiary alcohols
  • tricarboxylic acids and derivatives
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • fatty amide
  • tricarboxylic acid or derivatives
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • n-acyl-alpha amino acid or derivatives
  • alcohol
  • n-acyl-alpha-amino acid
  • glutamic acid or derivatives
  • carboxamide group
  • n-acyl-amine
  • secondary carboxylic acid amide
  • tertiary alcohol
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound