Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:17:46 UTC
Update Date2025-03-25 01:00:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02241870
Frequency0.5
Structure
Chemical FormulaC12H20O
Molecular Mass180.1514
SMILESCC(O)C12CC3CC(CC(C3)C1)C2
InChI KeyYALBLVPSPRKDJI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • secondary alcohol
  • hydrocarbon derivative
  • aliphatic homopolycyclic compound