Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:57:51 UTC
Update Date2025-03-24 22:26:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01197356
Frequency1.1
Structure
Chemical FormulaC8H16O2
Molecular Mass144.115
SMILESCC1COCC(C)(C)CO1
InChI KeyONOCFGPLKHUDQR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxepanes
Subclass 1,4-dioxepanes
Direct Parent 1,4-dioxepanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • ether
  • organic oxygen compound
  • 1,4-dioxepane
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • dialkyl ether
  • organooxygen compound