Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:19:31 UTC
Update Date2025-03-21 19:11:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00249730
Frequency8.4
Structure
Chemical FormulaC7H14O2
Molecular Mass130.0994
SMILESCCC=CC(O)(O)CC
InChI KeyDCNFNNFKJQRUGH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent carbonyl hydrates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organooxygen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl hydrate
  • hydrocarbon derivative