Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:51:31 UTC
Update Date2025-03-21 18:03:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00042146
Frequency81.2
Structure
Chemical FormulaC9H14O2
Molecular Mass154.0994
SMILESCCCCCC(=C=O)C(C)=O
InChI KeyQGKBQLZGIPAFHY-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
  • ketenes
  • ketones
  • organic oxides
  • ynolates
  • Substituents
  • ketone
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • ynolate
  • hydrocarbon derivative
  • acryloyl-group
  • ketene
  • enone