Hmdb loader

Showing information for DMID02203536

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:00 UTC
Update Date2025-03-25 00:54:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02203536
Frequency0.5
Structure
Chemical FormulaC11H16O4
Molecular Mass212.1049
SMILESO=C(O)CCCCCC=C1CCC(=O)O1
InChI KeyBXSSZNMTBFILLO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass medium-chain hydroxy acids and derivatives
Direct Parent medium-chain hydroxy acids and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • enol esters
  • fatty acyls
  • heterocyclic fatty acids
  • hydrocarbon derivatives
  • lactones
  • medium-chain fatty acids
  • organic oxides
  • oxacyclic compounds
  • tetrahydrofurans
    • Substituents
  • fatty acyl
  • carbonyl group
  • carboxylic acid
  • tetrahydrofuran
  • heterocyclic fatty acid
  • carboxylic acid derivative
  • medium-chain hydroxy acid
  • lactone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • medium-chain fatty acid
  • enol ester
  • organoheterocyclic compound
  • organooxygen compound