Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:17:30 UTC
Update Date2025-03-21 18:35:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00104236
Frequency26.0
Structure
Chemical FormulaC9H16O4
Molecular Mass188.1049
SMILESCCOC(=O)C(C)OC(=O)C(C)C
InChI KeyOREBFEQQQGFAKG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass dicarboxylic acids and derivatives
Direct Parent dicarboxylic acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • carboxylic acid ester
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organooxygen compound