Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:46:56 UTC
Update Date2025-03-24 14:03:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00739216
Frequency2.1
Structure
Chemical FormulaC5H10O4
Molecular Mass134.0579
SMILESCC(C)C(OO)C(=O)O
InChI KeyPDHYRSPSMMCUEH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent hydroperoxy fatty acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl hydroperoxides
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • methyl-branched fatty acids
  • monocarboxylic acids and derivatives
  • organic oxides
  • peroxols
  • short-chain hydroxy acids and derivatives
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • methyl-branched fatty acid
  • short-chain hydroxy acid
  • hydroperoxide
  • carboxylic acid derivative
  • branched fatty acid
  • peroxol
  • organic oxide
  • monocarboxylic acid or derivatives
  • alkyl hydroperoxide
  • organic oxygen compound
  • hydrocarbon derivative
  • hydroperoxy fatty acid
  • organooxygen compound