Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:32:15 UTC
Update Date2025-03-24 14:28:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00848371
Frequency1.7
Structure
Chemical FormulaC8H14O
Molecular Mass126.1045
SMILESCC1C=C(C(C)O)CC1
InChI KeyCBLXKDBKDAKFQP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative