Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:11:18 UTC
Update Date2025-03-24 19:56:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01084418
Frequency1.3
Structure
Chemical FormulaC6H10O3
Molecular Mass130.063
SMILESCC(C)(CO)C(O)=C=O
InChI KeySXCMNMTWLAGWJH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ynolates
Direct Parent ynolates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • organic oxide
  • ynolate
  • hydrocarbon derivative