Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:33 UTC
Update Date2025-03-21 18:41:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00135305
Frequency18.6
Structure
Chemical FormulaC11H9O5+
Molecular Mass221.0444
SMILESOc1ccc(-c2ccc(O)c(O)[o+]2)cc1O
InChI KeyVWXVTFSOMTXWAI-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzene and substituted derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic cations
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • monocyclic benzene moiety
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • oxacycle
  • organic oxygen compound
  • hydrocarbon derivative
  • organic cation
  • organoheterocyclic compound
  • organooxygen compound