Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:55:41 UTC
Update Date2025-03-24 20:32:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01479267
Frequency0.9
Structure
Chemical FormulaC9H16O
Molecular Mass140.1201
SMILESCCC(O)C1C=C(C)CC1
InChI KeyVQCSKAQUYVLJBU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • Substituents
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative