Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:26 UTC
Update Date2025-03-25 00:59:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02236558
Frequency0.5
Structure
Chemical FormulaC15H17N3O5
Molecular Mass319.1168
SMILESOCC(O)C(O)C(O)Cn1c2ccccc2c2ncnc(O)c21
InChI KeyPSWYTSRMNRWPAM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass n-alkylindoles
Direct Parent n-alkylindoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyrimidines
  • indoles
  • organonitrogen compounds
  • organopnictogen compounds
  • primary alcohols
  • pyrrolopyrimidines
  • secondary alcohols
  • substituted pyrroles
  • Substituents
  • alcohol
  • n-alkylindole
  • azacycle
  • indole
  • heteroaromatic compound
  • hydroxypyrimidine
  • substituted pyrrole
  • pyrimidine
  • pyrrolopyrimidine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • primary alcohol
  • organooxygen compound