Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:39:50 UTC
Update Date2025-03-21 22:53:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00580053
Frequency2.8
Structure
Chemical FormulaC6H12O2
Molecular Mass116.0837
SMILESCC1COCCOC1
InChI KeyNRAAJNMXMVXPTQ-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