Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:22 UTC
Update Date2025-03-25 00:47:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02163266
Frequency0.5
Structure
Chemical FormulaC16H14O6
Molecular Mass302.079
SMILESO=C(O)C1=CC(O)C(O)C(Oc2cccc3ccccc23)O1
InChI KeyHPSQDKMSUNZNCX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • acetals
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • phenol ethers
  • secondary alcohols
  • Substituents
  • alcohol
  • phenol ether
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • naphthalene
  • organic oxygen compound
  • acetal
  • aromatic heteropolycyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound
  • 1,2-diol