Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:41:22 UTC
Update Date2025-03-24 14:00:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00725792
Frequency2.1
Structure
Chemical FormulaC7H12O2
Molecular Mass128.0837
SMILESCC(C)CC(=C=O)CO
InChI KeyRWRRITKOBDXPIL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ketenes
Direct Parent ketenes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • hydrocarbon derivatives
  • organic oxides
  • ynolates
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • organic oxide
  • ynolate
  • hydrocarbon derivative
  • ketene