Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:54:00 UTC
Update Date2025-03-24 18:01:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01043732
Frequency1.3
Structure
Chemical FormulaC5H8O3
Molecular Mass116.0473
SMILESCOC(=O)C1COC1
InChI KeyKIKBCVAAHVENQY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent methyl esters
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • dialkyl ethers
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • oxetanes
  • Substituents
  • carbonyl group
  • ether
  • dialkyl ether
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • methyl ester
  • organic oxygen compound
  • oxetane
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound