Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:07:50 UTC
Update Date2025-03-24 14:12:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00789337
Frequency1.9
Structure
Chemical FormulaC8H12O2
Molecular Mass140.0837
SMILESCC1=CCC(C)(C=O)OC1
InChI KeyFXDQOAICVUPHPQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrans
Subclass pyrans
Direct Parent pyrans
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • aldehydes
  • dialkyl ethers
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • carbonyl group
  • ether
  • aldehyde
  • dialkyl ether
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • pyran
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound