Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:03:29 UTC
Update Date2025-03-21 19:02:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00212316
Frequency10.3
Structure
Chemical FormulaC5H6O2
Molecular Mass98.0368
SMILESO=C1CC2CC2O1
InChI KeyUHRXUDYFOJKBHF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactones
Subclass delta valerolactones
Direct Parent delta valerolactones
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • gamma butyrolactones
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • tetrahydrofurans
  • Substituents
  • carbonyl group
  • tetrahydrofuran
  • delta valerolactone
  • carboxylic acid derivative
  • gamma butyrolactone
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • oxane
  • delta_valerolactone
  • organooxygen compound