Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:52:07 UTC
Update Date2025-03-25 00:50:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02183326
Frequency0.5
Structure
Chemical FormulaC10H6O4
Molecular Mass190.0266
SMILESO=C1C(=O)c2c(O)cccc2C=C1O
InChI KeyNBTASFXKLWTZEF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthoquinones
Direct Parent naphthoquinones
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • aryl ketones
  • hydrocarbon derivatives
  • organic oxides
  • quinones
  • vinylogous acids
  • Substituents
  • carbonyl group
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • cyclic ketone
  • 1-hydroxy-4-unsubstituted benzenoid
  • ketone
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • naphthoquinone
  • organooxygen compound
  • aryl ketone
  • quinone