Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:29:16 UTC
Update Date2025-03-24 20:20:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01417441
Frequency0.9
Structure
Chemical FormulaC9H14O
Molecular Mass138.1045
SMILESCC1(C)CC(=O)C2CCC21
InChI KeyLLEXSUAYHIERFU-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