Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:03 UTC
Update Date2025-03-25 00:54:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02203652
Frequency0.5
Structure
Chemical FormulaC19H20O7
Molecular Mass360.1209
SMILESO=C(O)CCc1cc2cc(O)ccc2c(CCC(=O)O)c1CCC(=O)O
InChI KeyFCZHLAICHZFXSV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthols and derivatives
Direct Parent naphthols and derivatives
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • organic oxides
  • tricarboxylic acids and derivatives
  • Substituents
  • carbonyl group
  • carboxylic acid
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • tricarboxylic acid or derivatives
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • 2-naphthol
  • organooxygen compound