Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:45:35 UTC
Update Date2025-03-24 20:27:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01455217
Frequency0.9
Structure
Chemical FormulaC7H12O2
Molecular Mass128.0837
SMILESOC1CCC2COC2C1
InChI KeyAVJZHOPSIQGSAE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclic alcohols and derivatives
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • oxetanes
  • secondary alcohols
  • Substituents
  • ether
  • cyclic alcohol
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxacycle
  • oxetane
  • secondary alcohol
  • hydrocarbon derivative
  • organoheterocyclic compound