Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:01 UTC
Update Date2025-03-25 00:47:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02160228
Frequency0.5
Structure
Chemical FormulaC11H16O2
Molecular Mass180.115
SMILESC=CC1=CC(C)(O)C(C)(C)CC1=O
InChI KeyDNYMHFINHNOBEW-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
  • tertiary alcohols
  • Substituents
  • alcohol
  • cyclohexenone
  • tertiary alcohol
  • organic oxide
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative