Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:44:42 UTC
Update Date2025-03-25 00:48:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02166365
Frequency0.5
Structure
Chemical FormulaC13H24O2
Molecular Mass212.1776
SMILESCC1CCC(C)C(C)C2(CCC(C)O2)O1
InChI KeyGERIPDPOVHEFEP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • ketals
  • organooxygen compounds
  • oxacyclic compounds
  • tetrahydrofurans
  • Substituents
  • oxepane
  • oxacycle
  • organic oxygen compound
  • acetal
  • tetrahydrofuran
  • ketal
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound