Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:57:25 UTC
Update Date2025-03-25 00:52:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02195292
Frequency0.5
Structure
Chemical FormulaC13H22O3
Molecular Mass226.1569
SMILESCC1CCC(C2CCC(C)(CC(=O)O)O2)C1
InChI KeyLWXBGRSUKCJNRM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrahydrofurans
Subclass tetrahydrofurans
Direct Parent tetrahydrofurans
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dialkyl ethers
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • carbonyl group
  • ether
  • carboxylic acid
  • tetrahydrofuran
  • carboxylic acid derivative
  • dialkyl ether
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound