Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:57:32 UTC
Update Date2025-03-21 18:05:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00056297
Frequency56.6
Structure
Chemical FormulaC5H10O2S
Molecular Mass134.0402
SMILESCSC(C)(C)C(=O)O
InChI KeyCDFNSDKSYUXWQO-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
  • dialkylthioethers
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • sulfenyl compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • sulfenyl compound
  • dialkylthioether
  • organosulfur compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • thioether
  • hydrocarbon derivative
  • organooxygen compound