Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:00:30 UTC
Update Date2025-03-21 18:55:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00205318
Frequency10.8
Structure
Chemical FormulaC8H16O
Molecular Mass128.1201
SMILESC=CC(CCC)C(C)O
InChI KeyZALZJCFTXZXTGG-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