Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:45:26 UTC
Update Date2025-03-21 22:56:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00593411
Frequency2.7
Structure
Chemical FormulaC8H14O2
Molecular Mass142.0994
SMILESCC(=C=O)OCCC(C)C
InChI KeyNGHDXUGXCLUGMB-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