Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:06:03 UTC
Update Date2025-03-24 20:10:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01361627
Frequency1.0
Structure
Chemical FormulaC7H10O3
Molecular Mass142.063
SMILESCCC1(C)CC(=O)C(=O)O1
InChI KeyZDQZVKKCJWZVSZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdihydrofurans
Subclass furanones
Direct Parent furanones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carboxylic acid esters
  • cyclic ketones
  • gamma butyrolactones
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • tetrahydrofurans
  • Substituents
  • carbonyl group
  • tetrahydrofuran
  • cyclic ketone
  • carboxylic acid derivative
  • gamma butyrolactone
  • ketone
  • lactone
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • 3-furanone
  • organooxygen compound