Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:09:49 UTC
Update Date2025-03-25 01:19:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02361641
Frequency0.5
Structure
Chemical FormulaC6H10O3
Molecular Mass130.063
SMILESCC=COC(C)C(=O)O
InChI KeyDIZUNAYUNDCICB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acids
Direct Parent carboxylic acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • carboxylic acid
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound