Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:34:16 UTC
Update Date2025-03-24 20:22:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01429478
Frequency0.9
Structure
Chemical FormulaC7H12O2
Molecular Mass128.0837
SMILESCC1=COC(C)(O)CC1
InChI KeyVJHIUZODFHUNMB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent hemiacetals
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • aliphatic heteromonocyclic compound
  • hemiacetal
  • hydrocarbon derivative
  • organoheterocyclic compound