Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:18:13 UTC
Update Date2025-03-24 14:16:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00814150
Frequency1.8
Structure
Chemical FormulaC9H16O
Molecular Mass140.1201
SMILESC=C1C(C)CC(C)CC1O
InChI KeyPJQKQUKYZOFFCH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclic alcohols and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • secondary alcohols
  • Substituents
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • cyclic alcohol