Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:13:49 UTC
Update Date2025-03-21 19:07:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00236198
Frequency9.0
Structure
Chemical FormulaC7H10O
Molecular Mass110.0732
SMILESC=C(C=CC=O)CC
InChI KeyWSWNANHLCNHTIC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent medium-chain aldehydes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • hydrocarbon derivative
  • medium-chain aldehyde