Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:24 UTC
Update Date2025-03-25 00:45:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02152083
Frequency0.5
Structure
Chemical FormulaC14H23NO7
Molecular Mass317.1475
SMILESNC(CC(=O)OC(=O)CCCCCCCCC(=O)O)C(=O)O
InChI KeyRQDAFTRPHNIHEI-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
  • carbonyl compounds
  • carboxylic acid anhydrides
  • carboxylic acids
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • tetracarboxylic acids and derivatives
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • tetracarboxylic acid or derivatives
  • organic oxide
  • organic oxygen compound
  • aspartic acid or derivatives
  • organonitrogen compound
  • carboxylic acid anhydride
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound