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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:15 UTC
Update Date2025-03-25 00:57:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02222772
Frequency0.5
Structure
Chemical FormulaC5H13O14P3
Molecular Mass389.9518
SMILESO=P(O)(O)OCC1(O)OCC(COP(=O)(O)OP(=O)(O)O)O1
InChI KeyRLWQBMCODXINOZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganic oxoanionic compounds
Subclass organic pyrophosphates
Direct Parent organic pyrophosphates
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,3-dioxolanes
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • organic oxides
  • organooxygen compounds
  • orthocarboxylic acid derivatives
  • oxacyclic compounds
    • Substituents
  • meta-dioxolane
  • organic pyrophosphate
  • oxacycle
  • organic oxide
  • phosphoric acid ester
  • monoalkyl phosphate
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • orthocarboxylic acid derivative
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organoheterocyclic compound
  • organooxygen compound