Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:55:33 UTC
Update Date2025-03-25 00:52:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02191093
Frequency0.5
Structure
Chemical FormulaC9H14O2
Molecular Mass154.0994
SMILESC=CC1(C=O)CCCC(C)O1
InChI KeyBJVJVEVBNQDOKI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrans
Subclass pyran carboxylic acids and derivatives
Direct Parent pyran carboxylic acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • aldehydes
  • dialkyl ethers
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • pyrans
  • Substituents
  • carbonyl group
  • ether
  • pyran carboxylic acid or derivatives
  • aldehyde
  • dialkyl ether
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • oxane
  • organooxygen compound