Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:59:51 UTC
Update Date2025-03-24 21:52:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01919167
Frequency0.6
Structure
Chemical FormulaC8H14O2
Molecular Mass142.0994
SMILESCC(C)C1(O)CC=COC1
InChI KeyPVKYWZWTJDOEMU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • tertiary alcohol
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organoheterocyclic compound