Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:41:41 UTC
Update Date2025-03-21 22:54:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00584389
Frequency2.8
Structure
Chemical FormulaC4H8O2
Molecular Mass88.0524
SMILESCC(O)C1CO1
InChI KeyLEJLUUHSOFWJSW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • epoxides
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • ether
  • aliphatic heteromonocyclic compound
  • oxirane
  • secondary alcohol
  • hydrocarbon derivative
  • dialkyl ether
  • organoheterocyclic compound