Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:32:12 UTC
Update Date2025-03-24 17:51:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00991724
Frequency1.4
Structure
Chemical FormulaC7H10O3
Molecular Mass142.063
SMILESCC(O)C=C1CCC(=O)O1
InChI KeyAKPQRISWUFZGRC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrahydrofurans
Subclass tetrahydrofurans
Direct Parent tetrahydrofurans
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • enol esters
  • hydrocarbon derivatives
  • lactones
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • tetrahydrofuran
  • carboxylic acid derivative
  • lactone
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • enol ester
  • organooxygen compound