Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:16:06 UTC
Update Date2025-03-21 19:08:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00241558
Frequency8.8
Structure
Chemical FormulaC9H14O
Molecular Mass138.1045
SMILESCC12CCC(CC1)C(=O)C2
InChI KeyXGXFQWXNWVCHOG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent ketones
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • ketone
  • organic oxide
  • hydrocarbon derivative
  • aliphatic homopolycyclic compound