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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:50:41 UTC
Update Date2025-03-21 18:02:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00040130
Frequency121.5
Structure
Chemical FormulaC11H17NO9
Molecular Mass307.0903
SMILESCC(O)=NC1C(O)OC(C(=O)O)C(O)C1OC(C)C(=O)O
InChI KeyFEKMLTGLQNXHPO-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
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboximidic acids
  • carboxylic acids
  • dialkyl ethers
  • dicarboxylic acids and derivatives
  • hemiacetals
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • propargyl-type 1,3-dipolar organic compounds
  • pyran carboxylic acids
  • secondary alcohols
  • sugar acids and derivatives
    • Substituents
  • carboximidic acid
  • carbonyl group
  • ether
  • carboxylic acid
  • monosaccharide
  • carboxylic acid derivative
  • pyran carboxylic acid
  • dialkyl ether
  • n-acyl-alpha-hexosamine
  • propargyl-type 1,3-dipolar organic compound
  • muramic_acid
  • beta-hydroxy acid
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hemiacetal
  • oxane
  • organoheterocyclic compound
  • alcohol
  • pyran carboxylic acid or derivatives
  • organic 1,3-dipolar compound
  • hydroxy acid
  • oxacycle
  • pyran
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound