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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:02:46 UTC
Update Date2025-03-25 00:54:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02207584
Frequency0.5
Structure
Chemical FormulaC9H17O12P
Molecular Mass348.0458
SMILESO=C(C(O)C(O)COP(=O)(O)O)C1OC(O)C(O)C(O)C1O
InChI KeyODCQSLYNMJOBKM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent pentose phosphates
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acyloins
  • beta-hydroxy ketones
  • hemiacetals
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
    • Substituents
  • alcohol
  • beta-hydroxy ketone
  • carbonyl group
  • pentose phosphate
  • ketone
  • oxacycle
  • organic oxide
  • phosphoric acid ester
  • monoalkyl phosphate
  • acyloin
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organoheterocyclic compound