Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:52:17 UTC
Update Date2025-03-25 00:50:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02183707
Frequency0.5
Structure
Chemical FormulaC11H6O4
Molecular Mass202.0266
SMILESO=C1Oc2c(O)cc(O)c3cccc1c23
InChI KeyIITYEXUISUGVIW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthols and derivatives
Direct Parent naphthols and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • carboxylic acid esters
  • hydrocarbon derivatives
  • lactones
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • lactone
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • 1-naphthol
  • 2-naphthol
  • organoheterocyclic compound
  • organooxygen compound