Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:37 UTC
Update Date2025-03-25 01:01:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02246234
Frequency0.5
Structure
Chemical FormulaC12H16O
Molecular Mass176.1201
SMILESCC1(C)CC(=O)C=C2C=CCCC21
InChI KeyKENTWEVWOCHNDB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent cyclohexenones
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • cyclohexenone
  • organic oxide
  • hydrocarbon derivative
  • aliphatic homopolycyclic compound