Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:26:07 UTC
Update Date2025-03-21 18:39:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00124922
Frequency20.6
Structure
Chemical FormulaC9H16O
Molecular Mass140.1201
SMILESCC1=CCC(O)CC1(C)C
InChI KeyWCTRTZIKBCMFSU-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