Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:13:12 UTC
Update Date2025-03-21 22:12:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00516227
Frequency3.3
Structure
Chemical FormulaC4H6O2
Molecular Mass86.0368
SMILESCC(=O)C1CO1
InChI KeyYBWJKTAELMMCHQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent ketones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • epoxides
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • ether
  • oxirane
  • dialkyl ether
  • ketone
  • oxacycle
  • organic oxide
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organoheterocyclic compound