Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:13 UTC
Update Date2025-03-25 00:46:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02156290
Frequency0.5
Structure
Chemical FormulaC8H10O4
Molecular Mass170.0579
SMILESCC(=O)C1=C(O)OC(C)(C)C1=O
InChI KeyZYGHEOMGNKPZOU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdihydrofurans
Subclass furanones
Direct Parent furanones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • vinylogous acids
  • vinylogous esters
  • Substituents
  • carbonyl group
  • vinylogous ester
  • cyclic ketone
  • ketone
  • oxacycle
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • 3-furanone
  • organooxygen compound