Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:26:08 UTC
Update Date2025-03-21 19:16:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00264598
Frequency7.8
Structure
Chemical FormulaC8H14O
Molecular Mass126.1045
SMILESC=CC(C(=C)C)C(C)O
InChI KeyRDBHYQNFTXJKSU-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