Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:49:16 UTC
Update Date2025-03-21 22:57:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00602607
Frequency2.7
Structure
Chemical FormulaC7H10O3
Molecular Mass142.063
SMILESCCOC(=O)C1=COCC1
InChI KeyXPYPIHREWYSUPQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdihydrofurans
Subclass dihydrofurans
Direct Parent dihydrofurans
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • enoate esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • vinylogous esters
  • Substituents
  • enoate ester
  • carbonyl group
  • vinylogous ester
  • carboxylic acid derivative
  • oxacycle
  • alpha,beta-unsaturated carboxylic ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound
  • dihydrofuran