Hmdb loader

Showing information for DMID00082277

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:08:22 UTC
Update Date2025-03-21 18:30:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00082277
Frequency35.1
Structure
Chemical FormulaC5H6O2
Molecular Mass98.0368
SMILESC=C(C)C(=O)C=O
InChI KeyFQFOZLSNGJJYFH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-branched alpha,beta-unsaturated ketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acryloyl compounds
  • alpha ketoaldehydes
  • enones
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • short-chain aldehydes
    • Substituents
  • alpha-branched alpha,beta-unsaturated-ketone
  • aliphatic acyclic compound
  • short-chain aldehyde
  • aldehyde
  • ketone
  • organic oxide
  • hydrocarbon derivative
  • acryloyl-group
  • alpha-ketoaldehyde
  • enone