Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:39:12 UTC
Update Date2025-03-21 17:58:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00013648
Frequency326.8
Structure
Chemical FormulaC8H12O
Molecular Mass124.0888
SMILESCC1(C)CC=CC(=O)C1
InChI KeyCDDGRARTNILYAB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent cyclohexenones
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • cyclohexenone
  • organic oxide
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative