Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:47 UTC
Update Date2025-03-21 18:40:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00131311
Frequency19.3
Structure
Chemical FormulaC4H10O3
Molecular Mass106.063
SMILESCOCOCCO
InChI KeyINFFATMFXZFLAO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent acetals
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • hydrocarbon derivatives
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • acetal
  • hydrocarbon derivative