Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:10 UTC
Update Date2025-03-21 18:35:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00105849
Frequency25.5
Structure
Chemical FormulaC12H18O
Molecular Mass178.1358
SMILESCC1=C(C=CC=O)C(C)(C)CCC1
InChI KeyFLOPAOUVAMIAJN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasshydrocarbon derivatives
ClassNot Available
Subclass hydrocarbon derivatives
Direct Parent hydrocarbon derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • aldehydes
  • organic oxides
  • Substituents
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • aliphatic homomonocyclic compound
  • aldehyde
  • hydrocarbon derivative
  • organooxygen compound