Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:01:18 UTC
Update Date2025-03-21 18:55:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00207113
Frequency10.7
Structure
Chemical FormulaC9H14O
Molecular Mass138.1045
SMILESCC(=O)C=C=CC(C)(C)C
InChI KeyVBKWNUOVXVKFGB-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