Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:16 UTC
Update Date2025-03-21 18:40:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00130081
Frequency19.5
Structure
Chemical FormulaC10H20O2
Molecular Mass172.1463
SMILESCC1CCC(C(O)C(C)(C)O)C1
InChI KeyAUSSIGKQEHDTRO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • 1,2-diols
  • hydrocarbon derivatives
  • secondary alcohols
  • Substituents
  • tertiary alcohol
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • 1,2-diol