Hmdb loader

Showing information for DMID00055817

Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:57:20 UTC
Update Date2025-03-21 18:05:15 UTC
HMDB IDHMDB0014012
Metabolite Identification
DeepMet IDDMID00055817
NameOmeprazole sulfone
Frequency66.2
Structure
Chemical FormulaC17H19N3O4S
Molecular Mass361.1096
SMILESCOc1ccc2nc(S(=O)(=O)Cc3ncc(C)c(OC)c3C)[nH]c2c1
InChI KeyIXEQEYRTSRFZEO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzimidazoles
Subclass sulfinylbenzimidazoles
Direct Parent sulfinylbenzimidazoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • methylpyridines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • sulfones
    • Substituents
  • phenol ether
  • ether
  • polyhalopyridine
  • alkyl aryl ether
  • sulfinylbenzimidazole
  • organosulfur compound
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • azole
  • azacycle
  • heteroaromatic compound
  • methylpyridine
  • sulfonyl
  • pyridine
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound
  • sulfone