Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:25:54 UTC
Update Date2025-03-21 19:16:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00264066
Frequency7.8
Structure
Chemical FormulaC6H10O2
Molecular Mass114.0681
SMILESCC1CC(O)C=CO1
InChI KeyLSPXXBIMOLFCIX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • organoheterocyclic compound