Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:47 UTC
Update Date2025-03-25 01:01:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02251217
Frequency0.5
Structure
Chemical FormulaC13H8O4
Molecular Mass228.0423
SMILESO=c1oc(O)cc2c1ccc1ccc(O)cc12
InChI KeyIXNLXNDNVOKIFT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classnaphthopyrans
Subclass naphthopyrans
Direct Parent naphthopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 2-benzopyrans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • isocoumarins and derivatives
  • lactones
  • naphthols and derivatives
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • pyranones and derivatives
  • Substituents
  • benzopyran
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • isocoumarin
  • lactone
  • oxacycle
  • naphthopyran
  • organic oxide
  • naphthalene
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyran
  • 2-benzopyran
  • pyranone
  • hydrocarbon derivative
  • benzenoid
  • 2-naphthol
  • organooxygen compound