Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:39:50 UTC
Update Date2025-03-21 18:48:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00156888
Frequency15.3
Structure
Chemical FormulaC8H14O2
Molecular Mass142.0994
SMILESC1CCC2(CC1)OCCO2
InChI KeyGZGPRZYZKBQPBQ-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