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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:18 UTC
Update Date2025-03-25 00:47:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02163147
Frequency0.5
Structure
Chemical FormulaC8H15NO8
Molecular Mass253.0798
SMILESO=C(O)C(O)NCC1OC(O)C(O)C(O)C1O
InChI KeyVLQHPHLXKIMHQU-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 heteromonocyclic compounds
Alternative Parents
  • alkanolamines
  • alpha hydroxy acids and derivatives
  • amino acids
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • hemiacetals
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
  • Substituents
  • carbonyl group
  • carboxylic acid
  • amino acid
  • alpha-hydroxy acid
  • monosaccharide
  • saccharide
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hemiacetal
  • oxane
  • organoheterocyclic compound
  • alkanolamine
  • alcohol
  • secondary aliphatic amine
  • hydroxy acid
  • secondary amine
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine