Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:17:11 UTC
Update Date2025-03-21 22:14:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00525748
Frequency3.2
Structure
Chemical FormulaC7H8O
Molecular Mass108.0575
SMILESCC=C=C=CC(C)=O
InChI KeyKYGCDNJKLQMKFG-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