Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:41:19 UTC
Update Date2025-03-21 18:48:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00160404
Frequency14.9
Structure
Chemical FormulaC6H10O2
Molecular Mass114.0681
SMILESCCOC(=C=O)CC
InChI KeyNICTUNSBSJFVKG-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