Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:50:21 UTC
Update Date2025-03-25 00:28:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02039250
Frequency0.6
Structure
Chemical FormulaC8H14O
Molecular Mass126.1045
SMILESC=CC(O)C(C=C)CC
InChI KeyAGLMVIHDEKZHRS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • aliphatic acyclic compound
  • secondary alcohol
  • hydrocarbon derivative