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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:59:17 UTC
Update Date2025-03-25 00:53:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02199621
Frequency0.5
Structure
Chemical FormulaC12H18N2O7
Molecular Mass302.1114
SMILESNC(=O)C1=CN(C2C(O)OC(CO)C(O)C2O)C(=O)CC1
InChI KeyMYSYXJABYZXJSB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent n-acyl-alpha-hexosamines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hemiacetals
  • hydrocarbon derivatives
  • lactams
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • primary carboxylic acid amides
  • secondary alcohols
  • tertiary carboxylic acid amides
  • tetrahydropyridines
  • vinylogous amides
    • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • lactam
  • monosaccharide
  • carboxylic acid derivative
  • n-acyl-alpha-hexosamine
  • organic oxide
  • tertiary carboxylic acid amide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hemiacetal
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • vinylogous amide
  • azacycle
  • tetrahydropyridine
  • carboxamide group
  • oxacycle
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound