Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:12:51 UTC
Update Date2025-03-21 22:12:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00515427
Frequency3.3
Structure
Chemical FormulaC6H14O2
Molecular Mass118.0994
SMILESCCC(O)(O)C(C)C
InChI KeyLJOWJEKZXSHAQH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent carbonyl hydrates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organooxygen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl hydrate
  • hydrocarbon derivative