Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:11:50 UTC
Update Date2025-03-21 18:32:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00090380
Frequency31.2
Structure
Chemical FormulaC10H10O5
Molecular Mass210.0528
SMILESO=C(O)CC(O)CC1=CC(=O)C(=O)C=C1
InChI KeyJDDVXNNGWMBLKS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent carbocyclic fatty acids
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • beta hydroxy acids and derivatives
  • carboxylic acids
  • fatty acyls
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • monocarboxylic acids and derivatives
  • o-benzoquinones
  • organic oxides
  • quinones
  • secondary alcohols
  • short-chain hydroxy acids and derivatives
  • Substituents
  • alcohol
  • carbocyclic fatty acid
  • carbonyl group
  • carboxylic acid
  • short-chain hydroxy acid
  • o-benzoquinone
  • cyclic ketone
  • hydroxy acid
  • carboxylic acid derivative
  • ketone
  • beta-hydroxy acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • hydroxy fatty acid
  • organooxygen compound
  • quinone