Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:59:50 UTC
Update Date2025-03-25 00:32:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02061759
Frequency0.6
Structure
Chemical FormulaC7H12O2
Molecular Mass128.0837
SMILESCCOC(=O)C1(C)CC1
InChI KeyIZPYNZLFBUQGCZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass cyclopropanecarboxylic acids and derivatives
Direct Parent cyclopropanecarboxylic acids and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • cyclopropanecarboxylic acid or derivatives
  • carboxylic acid ester
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound