Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:17:30 UTC
Update Date2025-03-21 18:35:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00104207
Frequency26.0
Structure
Chemical FormulaC11H12O7
Molecular Mass256.0583
SMILESO=C(O)C1OOC(Oc2ccccc2)C(O)C1O
InChI KeyJRUATAHUQUKOMC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass phenol ethers
Direct Parent phenol ethers
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • 1,2-dioxanes
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • dialkyl peroxides
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • phenoxy compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • phenol ether
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • hydroxy acid
  • carboxylic acid derivative
  • oxacycle
  • beta-hydroxy acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • dialkyl peroxide
  • secondary alcohol
  • hydrocarbon derivative
  • phenoxy compound
  • ortho-dioxane
  • organoheterocyclic compound
  • organooxygen compound
  • 1,2-diol