Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:57 UTC
Update Date2025-03-25 00:47:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02162302
Frequency0.5
Structure
Chemical FormulaC12H14O6
Molecular Mass254.079
SMILESO=C(O)CC1(O)c2ccccc2C(O)C(O)C1O
InChI KeyJEIDHVJPEJQYGK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tetralins
Direct Parent tetralins
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • secondary alcohols
  • tertiary alcohols
  • Substituents
  • alcohol
  • tetralin
  • carbonyl group
  • carboxylic acid
  • aromatic homopolycyclic compound
  • carboxylic acid derivative
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound