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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:36 UTC
Update Date2025-03-25 00:47:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159322
Frequency0.5
Structure
Chemical FormulaC15H20NO9P
Molecular Mass389.0876
SMILESO=P(O)(O)OCC1OC(CO)C(Oc2c[nH]c3ccccc23)C(O)C1O
InChI KeyBXVWLUILFRELEJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent hexose phosphates
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • azacyclic compounds
  • benzenoids
  • dialkyl ethers
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • indoles
  • monoalkyl phosphates
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • pyrroles
  • secondary alcohols
  • Substituents
  • ether
  • indole
  • alkyl aryl ether
  • dialkyl ether
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • azacycle
  • heteroaromatic compound
  • indole or derivatives
  • oxacycle
  • phosphoric acid ester
  • monoalkyl phosphate
  • pyrrole
  • secondary alcohol
  • hexose phosphate
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • alkyl phosphate