Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:36:16 UTC
Update Date2025-03-24 13:59:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00713523
Frequency2.2
Structure
Chemical FormulaC8H14O2
Molecular Mass142.0994
SMILESCC12CCC(CC(O)O1)C2
InChI KeyYOANTCYVONTAQU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • hemiacetals
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • oxanes
  • Substituents
  • aliphatic heteropolycyclic compound
  • oxepane
  • oxacycle
  • organic oxygen compound
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • organooxygen compound