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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:15 UTC
Update Date2025-03-25 00:58:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02233877
Frequency0.5
Structure
Chemical FormulaC26H46N2O20
Molecular Mass706.2644
SMILESCC(=O)NC1C(C(O)C(O)CO)OC(OC2C(O)C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C2O)(C(=O)O)C1NC(C)C(O)CO
InChI KeySLUMKLIGFLNEGD-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 heteromonocyclic compounds
Alternative Parents
  • acetamides
  • amino acids
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • hemiacetals
  • hydrocarbon derivatives
  • ketals
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
  • secondary carboxylic acid amides
  • tetrahydrofurans
    • Substituents
  • carbonyl group
  • carboxylic acid
  • amino acid
  • monosaccharide
  • saccharide
  • organic oxide
  • acetal
  • ketal
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hemiacetal
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • acetamide
  • alcohol
  • secondary aliphatic amine
  • tetrahydrofuran
  • secondary amine
  • carboxamide group
  • beta amino acid or derivatives
  • oxacycle
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine