Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:37:35 UTC
Update Date2025-03-21 21:53:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00432503
Frequency4.1
Structure
Chemical FormulaC8H14O2
Molecular Mass142.0994
SMILESCC1(C)OCC(C2CC2)O1
InChI KeyKWMGSXKMKMJLFS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent ketals
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,3-dioxolanes
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • meta-dioxolane
  • ketal
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organoheterocyclic compound