Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:01:02 UTC
Update Date2025-03-24 20:59:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01636144
Frequency0.8
Structure
Chemical FormulaC7H10O2
Molecular Mass126.0681
SMILESCC12CCC3OC3C1O2
InChI KeyARSOECUIMCJYEB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • epoxides
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • aliphatic heteropolycyclic compound
  • oxepane
  • oxacycle
  • ether
  • organic oxygen compound
  • oxirane
  • hydrocarbon derivative
  • dialkyl ether
  • organooxygen compound