Hmdb loader

Showing information for DMID02155608

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:54 UTC
Update Date2025-03-25 00:46:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155608
Frequency0.5
Structure
Chemical FormulaC9H14O3
Molecular Mass170.0943
SMILESCC(=O)C(=O)C(C)C(=O)C(C)C
InChI KeyZCDKXSMHORXQTF-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
  • alpha-diketones
  • hydrocarbon derivatives
  • organic oxides
    • Substituents
  • ketone
  • aliphatic acyclic compound
  • organic oxide
  • hydrocarbon derivative
  • alpha-diketone
  • 1,3-diketone