Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:37:15 UTC
Update Date2025-03-21 17:57:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00009067
Frequency534.9
Structure
Chemical FormulaC7H13NO4
Molecular Mass175.0845
SMILESCC(C)C(=O)OCC(N)C(=O)O
InChI KeyDDKUGZLBDYPQMH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • organic oxide
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • alpha-amino acid
  • dicarboxylic acid or derivatives
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound