Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:42:57 UTC
Update Date2025-03-21 17:59:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00021914
Frequency188.0
Structure
Chemical FormulaC7H11NO5
Molecular Mass189.0637
SMILESCC(=O)NC(CC(=O)O)CC(=O)O
InChI KeyDROVPNWDFADZFG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent beta amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acetamides
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • fatty acids and conjugates
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • fatty acid
  • carboxamide group
  • beta amino acid or derivatives
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • dicarboxylic acid or derivatives
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • acetamide
  • organooxygen compound