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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:07 UTC
Update Date2025-03-21 18:38:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00122624
Frequency21.1
Structure
Chemical FormulaC12H21NO7
Molecular Mass291.1318
SMILESCC(C)=NC1C(O)OC(CO)C(O)C1OC(C)C(=O)O
InChI KeyGSNNKKJSHOYBPJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent sugar acids and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dialkyl ethers
  • hemiacetals
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
  • secondary ketimines
    • Substituents
  • ketimine
  • carbonyl group
  • ether
  • carboxylic acid
  • imine
  • monosaccharide
  • carboxylic acid derivative
  • dialkyl ether
  • propargyl-type 1,3-dipolar organic compound
  • secondary ketimine
  • muramic_acid
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hemiacetal
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • organic 1,3-dipolar compound
  • oxacycle
  • monocarboxylic acid or derivatives
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound