Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:52:54 UTC
Update Date2025-03-21 22:59:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00611079
Frequency2.6
Structure
Chemical FormulaC7H10O3
Molecular Mass142.063
SMILESCC(=O)C(C(C)=O)C(C)=O
InChI KeyAUZFRUHVDNDVJI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent beta-diketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • Substituents
  • ketone
  • aliphatic acyclic compound
  • organic oxide
  • hydrocarbon derivative
  • 1,3-diketone