Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:34:05 UTC
Update Date2025-03-21 21:51:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00424063
Frequency4.2
Structure
Chemical FormulaC7H14O2
Molecular Mass130.0994
SMILESC=C(C)CC(C)(O)CO
InChI KeyNQVRHHYYKWCTPC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,2-diols
  • hydrocarbon derivatives
  • Substituents
  • aliphatic acyclic compound
  • tertiary alcohol
  • hydrocarbon derivative
  • 1,2-diol