Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:24:00 UTC
Update Date2025-03-24 14:18:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00828461
Frequency1.8
Structure
Chemical FormulaC6H7O2+
Molecular Mass111.0441
SMILESOCc1ccc[o+]c1
InChI KeyYHURZCSWTOKPFI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classheteroaromatic compounds
Subclass heteroaromatic compounds
Direct Parent heteroaromatic compounds
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • hydrocarbon derivatives
  • organic cations
  • oxacyclic compounds
  • Substituents
  • aromatic alcohol
  • alcohol
  • oxacycle
  • organic oxygen compound
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • hydrocarbon derivative
  • organic cation
  • organooxygen compound