Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:40 UTC
Update Date2025-03-25 00:47:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159476
Frequency0.5
Structure
Chemical FormulaC8H12O2
Molecular Mass140.0837
SMILESO=CC=CC1(O)CCCC1
InChI KeyZGTHNISOVRSAGX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclopentanols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • aldehydes
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • tertiary alcohols
  • Substituents
  • carbonyl group
  • tertiary alcohol
  • organic oxide
  • aliphatic homomonocyclic compound
  • aldehyde
  • hydrocarbon derivative
  • cyclic alcohol
  • cyclopentanol