Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:38:26 UTC
Update Date2025-03-21 17:58:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00011841
Frequency387.6
Structure
Chemical FormulaC6H11NO4
Molecular Mass161.0688
SMILESCN(C)C(CC(=O)O)C(=O)O
InChI KeyAXWJKQDGIVWVEW-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
  • dicarboxylic acids and derivatives
  • fatty acids and conjugates
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • amino acid
  • tertiary aliphatic amine
  • fatty acid
  • organic oxide
  • organic oxygen compound
  • alpha-amino acid
  • aspartic acid or derivatives
  • organonitrogen compound
  • dicarboxylic acid or derivatives
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound