Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:24 UTC
Update Date2025-03-25 00:49:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02172513
Frequency0.5
Structure
Chemical FormulaC11H16O
Molecular Mass164.1201
SMILESCCC1=C(C)CC(C)=C1C(C)=O
InChI KeyBOJMDYLNSAXKSB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent ketones
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • ketone
  • organic oxide
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative