Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-21 00:12:19 UTC
Update Date2025-03-21 18:32:35 UTC
HMDB IDHMDB0002441
Metabolite Identification
DeepMet IDDMID00091552
Name3,3-Dimethylglutaric acid
Frequency30.6
Structure
Chemical FormulaC7H12O4
Molecular Mass160.0736
SMILESCC(C)(CC(=O)O)CC(=O)O
InChI KeyDUHQIGLHYXLKAE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent methyl-branched fatty acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • methyl-branched fatty acid
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organooxygen compound