Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:41:57 UTC
Update Date2025-03-21 17:59:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00019685
Frequency207.2
Structure
Chemical FormulaC6H14O2
Molecular Mass118.0994
SMILESCCCC(O)(O)CC
InChI KeyAGGFJZYMAXECOR-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