Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:14:03 UTC
Update Date2025-03-24 21:32:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01811102
Frequency0.7
Structure
Chemical FormulaC6H10O2
Molecular Mass114.0681
SMILESC=C(C=O)C(C)CO
InChI KeyZDGBNOGZGMOOCB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent primary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldehydes
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • aldehyde
  • hydrocarbon derivative
  • primary alcohol