Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:47:34 UTC
Update Date2025-03-24 21:47:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01890180
Frequency0.6
Structure
Chemical FormulaC7H10O3
Molecular Mass142.063
SMILESCCCC(C=C=O)C(=O)O
InChI KeyXROYAOJQVRGTPJ-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
  • fatty acyls
  • hydrocarbon derivatives
  • ketenes
  • monocarboxylic acids and derivatives
  • organic oxides
  • ynolates
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • methyl-branched fatty acid
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • ynolate
  • hydrocarbon derivative
  • ketene
  • organooxygen compound