Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:52:28 UTC
Update Date2025-03-24 14:37:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00896302
Frequency1.6
Structure
Chemical FormulaC6H14O2
Molecular Mass118.0994
SMILESCCCC(C)C(O)O
InChI KeyACOQOLIJGGKILA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent carbonyl hydrates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organooxygen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl hydrate
  • hydrocarbon derivative