Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:44:31 UTC
Update Date2025-03-25 00:48:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02165957
Frequency0.5
Structure
Chemical FormulaC12H20O
Molecular Mass180.1514
SMILESCC1=CCCC(O)C12CCC(C)C2
InChI KeyPONOKMGNCLFDRU-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