Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:39:56 UTC
Update Date2025-03-21 21:54:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00438089
Frequency4.1
Structure
Chemical FormulaC9H16O
Molecular Mass140.1201
SMILESCC1CC2(O)CCC1CC2
InChI KeyXLOUGBSGKLXIJW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • Substituents
  • tertiary alcohol
  • hydrocarbon derivative
  • cyclic alcohol
  • aliphatic homopolycyclic compound