Hmdb loader
Record Information
HMDB Statusdetected
Creation Date2024-02-21 01:14:31 UTC
Update Date2025-03-21 19:08:04 UTC
HMDB IDHMDB0243911
Metabolite Identification
DeepMet IDDMID00237864
Name1-Isopropoxy-2-propanol
Frequency8.9
Structure
Chemical FormulaC6H14O2
Molecular Mass118.0994
SMILESCC(O)COC(C)C
InChI KeyAFHJYKBGDDJSRR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • Substituents
  • aliphatic acyclic compound
  • ether
  • secondary alcohol
  • hydrocarbon derivative
  • dialkyl ether