Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:41:09 UTC
Update Date2025-03-24 17:55:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01013166
Frequency1.4
Structure
Chemical FormulaC9H18O
Molecular Mass142.1358
SMILESCC1CCCCC(C)(C)O1
InChI KeyXFBSTIGUHYFXHZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • oxepane
  • oxacycle
  • ether
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • dialkyl ether
  • organooxygen compound