Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:34 UTC
Update Date2025-03-21 18:41:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00135350
Frequency18.5
Structure
Chemical FormulaC11H8O5
Molecular Mass220.0372
SMILESO=c1cc(O)cc(-c2ccc(O)c(O)c2)o1
InChI KeyPCXACMMNKRJXLL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrans
Subclass pyranones and derivatives
Direct Parent pyranones and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzene and substituted derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactones
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • vinylogous acids
  • Substituents
  • monocyclic benzene moiety
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • lactone
  • oxacycle
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • pyranone
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound