Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:43 UTC
Update Date2025-03-21 18:40:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00131161
Frequency19.3
Structure
Chemical FormulaC7H15NO5
Molecular Mass193.095
SMILESCN(CC(=O)O)CC(O)C(O)CO
InChI KeyMCPLCBLISOPTHL-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
  • 1,2-aminoalcohols
  • 1,3-aminoalcohols
  • amino acids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • primary alcohols
  • secondary alcohols
  • trialkylamines
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • amino acid
  • organic oxide
  • alpha-amino acid
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • tertiary amine
  • alcohol
  • 1,3-aminoalcohol
  • 1,2-aminoalcohol
  • tertiary aliphatic amine
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound