Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:46:09 UTC
Update Date2025-03-21 18:00:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00029324
Frequency127.6
Structure
Chemical FormulaC8H15N2O7P
Molecular Mass282.0617
SMILESO=P(O)(O)OCC(O)C(O)C(O)Cn1ccnc1
InChI KeyLMABGVINBBPDOA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic phosphoric acids and derivatives
Subclass phosphate esters
Direct Parent monoalkyl phosphates
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • n-substituted imidazoles
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organic oxide
  • organic oxygen compound
  • imidazole
  • monoalkyl phosphate
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound
  • azole
  • n-substituted imidazole