Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:42 UTC
Update Date2025-03-25 00:47:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02164030
Frequency0.5
Structure
Chemical FormulaC12H20O2
Molecular Mass196.1463
SMILESCC1=C(C(C)C(=O)O)CC(C)(C)CC1
InChI KeyYLZDQEZKEJJYJY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass monoterpenoids
Direct Parent monocyclic monoterpenoids
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • monocyclic monoterpenoid
  • carboxylic acid
  • organic oxygen compound
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • carboxylic acid derivative
  • organooxygen compound