Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:20:33 UTC
Update Date2025-03-24 14:17:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00819935
Frequency1.8
Structure
Chemical FormulaC6H10O
Molecular Mass98.0732
SMILESCC1(O)CC=CC1
InChI KeyJHWXOSAKBPNLCH-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