Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:12 UTC
Update Date2025-03-25 00:45:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02149238
Frequency0.5
Structure
Chemical FormulaC11H15NO9
Molecular Mass305.0747
SMILESO=C(O)CCC(=O)OC(CCC(O)=NCC(=O)O)C(=O)O
InChI KeyNZWZPPLFPVPFSD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass tetracarboxylic acids and derivatives
Direct Parent tetracarboxylic acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha amino acids
  • carbonyl compounds
  • carboximidic acids
  • carboxylic acid esters
  • carboxylic acids
  • fatty acid esters
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carboximidic acid
  • carbonyl group
  • carboxylic acid
  • tetracarboxylic acid or derivatives
  • organic 1,3-dipolar compound
  • alpha-amino acid or derivatives
  • propargyl-type 1,3-dipolar organic compound
  • fatty acid ester
  • organic oxide
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound