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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:19:02 UTC
Update Date2025-03-21 18:35:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00107984
Frequency24.9
Structure
Chemical FormulaC11H17NO8
Molecular Mass291.0954
SMILESCC(O)=NC1C(=O)OC(CO)C(O)C1OC(C)C(=O)O
InChI KeyHLWXLAISNKSBMF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acid esters
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acids
  • aminosaccharides
  • carbonyl compounds
  • carboximidic acids
  • carboxylic acid esters
  • carboxylic acids
  • delta valerolactones
  • dialkyl ethers
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
  • Substituents
  • carboximidic acid
  • carbonyl group
  • ether
  • carboxylic acid
  • delta valerolactone
  • monosaccharide
  • dialkyl ether
  • propargyl-type 1,3-dipolar organic compound
  • lactone
  • saccharide
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • oxane
  • primary alcohol
  • delta_valerolactone
  • organoheterocyclic compound
  • alcohol
  • amino saccharide
  • alpha-amino acid ester
  • organic 1,3-dipolar compound
  • oxacycle
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound