Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:02:35 UTC
Update Date2025-03-24 19:52:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01063504
Frequency1.3
Structure
Chemical FormulaC8H14O2
Molecular Mass142.0994
SMILESCC1(O)CCC=C(CO)C1
InChI KeyOBGRNHLBQSOQOO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • tertiary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative