Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:14 UTC
Update Date2025-03-25 00:46:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02156343
Frequency0.5
Structure
Chemical FormulaC6H14NO6P+
Molecular Mass227.0553
SMILESC[N+]1CC(O)C(O)C1COP(=O)(O)O
InChI KeyLQVNMSUDCHJLCD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic phosphoric acids and derivatives
Subclass phosphate esters
Direct Parent monoalkyl phosphates
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • azacyclic compounds
  • hydrocarbon derivatives
  • n-alkylpyrrolidines
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • azacycle
  • n-alkylpyrrolidine
  • organic oxide
  • organic oxygen compound
  • monoalkyl phosphate
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • pyrrolidine
  • organoheterocyclic compound
  • organooxygen compound
  • 1,2-diol