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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:44:23 UTC
Update Date2025-03-25 00:48:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02165634
Frequency0.5
Structure
Chemical FormulaC5H12O7P2
Molecular Mass246.0058
SMILESCC=CCCOP(=O)(O)OP(=O)(O)O
InChI KeyLMCPORVNKBBBFL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganic oxoanionic compounds
Subclass organic pyrophosphates
Direct Parent organic pyrophosphates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • organic oxides
  • organooxygen compounds
    • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • phosphoric acid ester
  • monoalkyl phosphate
  • hydrocarbon derivative
  • organic phosphoric acid derivative
  • organic pyrophosphate
  • alkyl phosphate
  • organooxygen compound