Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:11:32 UTC
Update Date2025-03-25 00:57:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02227790
Frequency0.5
Structure
Chemical FormulaC10H14O5
Molecular Mass214.0841
SMILESCC(=O)CC(=O)CCCC(=O)OC(C)=O
InChI KeyYJJBIOPJTRTSTR-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
  • carboxylic acid anhydrides
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • Substituents
  • ketone
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • carboxylic acid anhydride
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organooxygen compound