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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:23 UTC
Update Date2025-03-25 00:50:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02181665
Frequency0.5
Structure
Chemical FormulaC9H10NO10P
Molecular Mass323.0042
SMILESO=C(O)C1=CC(=C(OP(=O)(O)O)C(=O)O)CC(C(=O)O)N1
InChI KeySXOVYGDRRNZZFC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • phosphate esters
  • tetrahydropyridines
  • tricarboxylic acids and derivatives
  • Substituents
  • carbonyl group
  • carboxylic acid
  • amino acid
  • tricarboxylic acid or derivatives
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organoheterocyclic compound
  • secondary aliphatic amine
  • azacycle
  • tetrahydropyridine
  • secondary amine
  • organic oxygen compound
  • phosphoric acid ester
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • organooxygen compound
  • amine