Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:23:52 UTC
Update Date2025-03-21 19:13:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00259555
Frequency8.0
Structure
Chemical FormulaC5H12O2
Molecular Mass104.0837
SMILESCCOC(C)(C)O
InChI KeyMGMXTRZFWPWZFH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent hemiketals
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organooxygen compounds
  • Substituents
  • aliphatic acyclic compound
  • hemiketal
  • hydrocarbon derivative