Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:39 UTC
Update Date2025-03-25 00:45:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150311
Frequency0.5
Structure
Chemical FormulaC13H16O
Molecular Mass188.1201
SMILESCC1(C)C2=CC(=O)C2(C)C2C=CC1C2
InChI KeyMCVWOALSJVNWNA-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