Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:38:42 UTC
Update Date2025-03-24 14:31:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00863629
Frequency1.7
Structure
Chemical FormulaC7H16O2
Molecular Mass132.115
SMILESCC(O)C(C)(C)CCO
InChI KeyIYBKMQPSCYKLDV-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
  • hydrocarbon derivatives
  • Substituents
  • aliphatic acyclic compound
  • secondary alcohol
  • hydrocarbon derivative