Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:39:17 UTC
Update Date2025-03-24 14:31:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00864984
Frequency1.7
Structure
Chemical FormulaC8H14O2
Molecular Mass142.0994
SMILESCC1(C)CC(=O)CC1(C)O
InChI KeyOBCVUPAWGZSNOQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclopentanols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclic alcohols and derivatives
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • tertiary alcohols
  • Substituents
  • carbonyl group
  • cyclic ketone
  • cyclic alcohol
  • cyclopentanol
  • ketone
  • tertiary alcohol
  • organic oxide
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative