Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:31:55 UTC
Update Date2025-03-21 18:42:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00138477
Frequency18.0
Structure
Chemical FormulaC7H12O3
Molecular Mass144.0786
SMILESCCC=CCCOC(=O)O
InChI KeyGVUUXOBWIZHGEI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic carbonic acids and derivatives
Subclass carbonic acid monoesters
Direct Parent carbonic acid monoesters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • carbonic acid monoester
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound