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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:38 UTC
Update Date2025-03-25 00:54:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02205000
Frequency0.5
Structure
Chemical FormulaC18H33O19P
Molecular Mass584.1354
SMILESO=P(O)(O)OCC1OC(O)C(OC2OC(CO)C(O)C(OC3OC(CO)C(O)C(O)C3O)C2O)C(O)C1O
InChI KeyJAECYMGSXLOAKL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent hexose phosphates
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • hemiacetals
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
    • Substituents
  • alcohol
  • oxacycle
  • organic oxide
  • acetal
  • phosphoric acid ester
  • monoalkyl phosphate
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hexose phosphate
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • primary alcohol
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organoheterocyclic compound