Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:43:09 UTC
Update Date2025-03-24 21:45:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01879713
Frequency0.6
Structure
Chemical FormulaC7H14O2
Molecular Mass130.0994
SMILESC=C(CO)CC(C)CO
InChI KeyYVTOIAZYRLAKQZ-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
  • hydrocarbon derivatives
  • Substituents
  • aliphatic acyclic compound
  • hydrocarbon derivative
  • primary alcohol