Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:18:02 UTC
Update Date2025-03-25 01:00:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02242470
Frequency0.5
Structure
Chemical FormulaC15H20O
Molecular Mass216.1514
SMILESC=CC=C(C)C(=O)C1=C(C)C=CCC1(C)C
InChI KeySKMQONLXTSNJQM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-branched alpha,beta-unsaturated ketones
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • Substituents
  • ketone
  • alpha-branched alpha,beta-unsaturated-ketone
  • organic oxide
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative