Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:12 UTC
Update Date2025-03-25 00:48:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02169761
Frequency0.5
Structure
Chemical FormulaC7H12O2
Molecular Mass128.0837
SMILESCCOC(=C=O)C(C)C
InChI KeyYNZAAXPYYQODPN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ynolates
Direct Parent ynolates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • ynolate
  • hydrocarbon derivative