Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:05:10 UTC
Update Date2025-03-24 20:36:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01501988
Frequency0.8
Structure
Chemical FormulaC8H12O
Molecular Mass124.0888
SMILESC=C=CC(=O)C(C)CC
InChI KeyJBCYBJGGCGYCAG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass acryloyl compounds
Direct Parent acryloyl compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • enones
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • Substituents
  • ketone
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • hydrocarbon derivative
  • acryloyl-group
  • enone