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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:55:55 UTC
Update Date2025-03-25 00:52:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02191952
Frequency0.5
Structure
Chemical FormulaC12H20NO11P
Molecular Mass385.0774
SMILESCC(=O)NC1C(O)CC(O)=C(C(=O)O)C1C(O)C(O)COP(=O)(O)O
InChI KeyANSMOBUFPZBWPN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent gamma amino acids and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • acetamides
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • secondary carboxylic acid amides
  • vinylogous acids
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • gamma amino acid or derivatives
  • carboxamide group
  • secondary carboxylic acid amide
  • vinylogous acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • organonitrogen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • alkyl phosphate
  • acetamide
  • organooxygen compound