Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:19:19 UTC
Update Date2025-03-24 14:16:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00816916
Frequency1.8
Structure
Chemical FormulaC6H10O2
Molecular Mass114.0681
SMILESC1CC2CCC(O1)O2
InChI KeyOIEHLJRTPUHJJY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,3-dioxanes
  • acetals
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • tetrahydrofurans
  • Substituents
  • aliphatic heteropolycyclic compound
  • oxepane
  • oxacycle
  • organic oxygen compound
  • acetal
  • tetrahydrofuran
  • hydrocarbon derivative
  • meta-dioxane
  • organooxygen compound