Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:46:22 UTC
Update Date2025-03-21 20:02:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00311077
Frequency6.3
Structure
Chemical FormulaC7H16O2
Molecular Mass132.115
SMILESCC(C)C(C)(CO)CO
InChI KeyNJHQOQAEEYIWOB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent alcohols and polyols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • hydrocarbon derivative