Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:19:40 UTC
Update Date2025-03-21 18:36:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00109556
Frequency24.4
Structure
Chemical FormulaC8H16O3
Molecular Mass160.1099
SMILESCC1CC(O)C(O)CC1(C)O
InChI KeyCMOHJQSLUSDBQK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclohexanols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclitols and derivatives
  • hydrocarbon derivatives
  • tertiary alcohols
  • Substituents
  • tertiary alcohol
  • cyclohexanol
  • aliphatic homomonocyclic compound
  • cyclitol or derivatives
  • hydrocarbon derivative
  • cyclic alcohol