Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:44:28 UTC
Update Date2025-03-25 00:48:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02165834
Frequency0.5
Structure
Chemical FormulaC20H30O4
Molecular Mass334.2144
SMILESCC1C=C2C=CC(C)(C)C(CCC(=O)O)C2C(OC(=O)C(C)C)C1
InChI KeyUZEHXPYLIYOWOX-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 homopolycyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • carboxylic acids
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • carbonyl group
  • organic oxide
  • carboxylic acid
  • organic oxygen compound
  • carboxylic acid ester
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organooxygen compound
  • aliphatic homopolycyclic compound