Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:53:44 UTC
Update Date2025-03-24 21:49:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01904522
Frequency0.6
Structure
Chemical FormulaC7H8O3
Molecular Mass140.0473
SMILESCC(=O)C=C(C)C(O)=C=O
InChI KeyUGRPDCXYYLXMSM-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
  • ynolates
  • Substituents
  • ketone
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • ynolate
  • hydrocarbon derivative
  • acryloyl-group
  • alpha,beta-unsaturated ketone
  • enone