Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:17:22 UTC
Update Date2025-03-25 01:00:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02240939
Frequency0.5
Structure
Chemical FormulaC10H18O4
Molecular Mass202.1205
SMILESCC(C)(O)C1CCC(CC(=O)O)OC1
InChI KeyIQHVNRXGIPBTNE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxanes
Subclass oxanes
Direct Parent oxanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dialkyl ethers
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • tertiary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • ether
  • carboxylic acid
  • carboxylic acid derivative
  • dialkyl ether
  • oxacycle
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • oxane
  • organooxygen compound