Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:14:48 UTC
Update Date2025-03-24 20:40:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01525776
Frequency0.8
Structure
Chemical FormulaC5H10O2
Molecular Mass102.0681
SMILESCC(O)C1(C)CO1
InChI KeyGSZYRUXKQZWHKE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • epoxides
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • ether
  • aliphatic heteromonocyclic compound
  • oxirane
  • secondary alcohol
  • hydrocarbon derivative
  • dialkyl ether
  • organoheterocyclic compound