Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:07:57 UTC
Update Date2025-03-21 18:30:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00081284
Frequency35.7
Structure
Chemical FormulaC14H8O5
Molecular Mass256.0372
SMILESO=C1CCc2c1c(=O)oc1c2oc2cc(O)ccc21
InChI KeyVAYBHMAWALKDHF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzofurans
Subclass benzofurans
Direct Parent benzofurans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • aryl alkyl ketones
  • benzenoids
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactones
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • pyranones and derivatives
  • Substituents
  • furan
  • aryl alkyl ketone
  • benzofuran
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • ketone
  • lactone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyran
  • pyranone
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • aryl ketone