Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:49 UTC
Update Date2025-03-25 00:58:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02232860
Frequency0.5
Structure
Chemical FormulaC16H24O2
Molecular Mass248.1776
SMILESCC=CC(=O)C=CC1C(C)(C)CC(=O)CC1(C)C
InChI KeySSMKAVDUXYXUMR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass sesquiterpenoids
Direct Parent sesquiterpenoids
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • acryloyl compounds
  • cyclic ketones
  • enones
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • carbonyl group
  • megastigmane sesquiterpenoid
  • cyclic ketone
  • alpha,beta-unsaturated ketone
  • ketone
  • organic oxide
  • sesquiterpenoid
  • organic oxygen compound
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • acryloyl-group
  • organooxygen compound
  • enone