Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:02 UTC
Update Date2025-03-25 00:46:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155900
Frequency0.5
Structure
Chemical FormulaC12H28N2O5P+
Molecular Mass311.173
SMILESC[N+](C)(C)CCCCCCC(=O)C(N)COP(=O)(O)O
InChI KeyCBWYNTVJCSLLHH-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic phosphoric acids and derivatives
Subclass phosphate esters
Direct Parent phosphoethanolamines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amines
  • hydrocarbon derivatives
  • ketones
  • monoalkyl phosphates
  • monoalkylamines
  • organic cations
  • organic oxides
  • organic salts
  • organopnictogen compounds
  • tetraalkylammonium salts
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • tetraalkylammonium salt
  • quaternary ammonium salt
  • ketone
  • phosphoethanolamine
  • organic oxide
  • organic oxygen compound
  • monoalkyl phosphate
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organic cation
  • organic salt
  • amine
  • alkyl phosphate
  • organooxygen compound