Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:07:48 UTC
Update Date2025-03-21 20:47:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00361492
Frequency5.2
Structure
Chemical FormulaC7H10O3
Molecular Mass142.063
SMILESCC(C(=O)O)C(=O)C1CC1
InChI KeyNGRGKULPJCORSH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent carbocyclic fatty acids
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • 1,3-dicarbonyl compounds
  • beta-hydroxy ketones
  • beta-keto acids and derivatives
  • carboxylic acids
  • fatty acyls
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • beta-hydroxy ketone
  • carbocyclic fatty acid
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • beta-keto acid
  • ketone
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • keto acid
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • 1,3-dicarbonyl compound
  • organooxygen compound