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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:51 UTC
Update Date2025-03-25 00:46:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02157673
Frequency0.5
Structure
Chemical FormulaC9H13NO7
Molecular Mass247.0692
SMILESO=C(O)CCC1NC(=O)C(C(O)CO)OC1=O
InChI KeyDQMDYDRWSBLSEJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classpeptidomimetics
Subclass hybrid peptides
Direct Parent hybrid peptides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • alpha amino acid esters
  • alpha amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acid esters
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • lactams
  • lactones
  • morpholines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • secondary alcohols
  • secondary carboxylic acid amides
  • Substituents
  • carbonyl group
  • lactam
  • carboxylic acid
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • lactone
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • primary alcohol
  • organoheterocyclic compound
  • 1,2-diol
  • cyclic hybrid peptide
  • alcohol
  • alpha-amino acid ester
  • azacycle
  • carboxamide group
  • oxazinane
  • oxacycle
  • secondary carboxylic acid amide
  • morpholine
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound