Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:59:04 UTC
Update Date2025-03-21 18:05:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00059960
Frequency52.3
Structure
Chemical FormulaC8H8O4
Molecular Mass168.0423
SMILESO=C(O)C(O)Oc1ccccc1
InChI KeyUXWHGEBSCAHINE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenoxyacetic acid derivatives
Direct Parent phenoxyacetic acid derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alpha hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • hemiacetals
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • phenol ethers
  • phenoxy compounds
  • Substituents
  • phenol ether
  • phenoxyacetate
  • carbonyl group
  • carboxylic acid
  • alpha-hydroxy acid
  • hydroxy acid
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hemiacetal
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound