Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-21 01:28:12 UTC
Update Date2025-03-21 19:18:06 UTC
HMDB IDHMDB0040185
Metabolite Identification
DeepMet IDDMID00269446
Name3-Mercapto-2-butanol
Frequency7.6
Structure
Chemical FormulaC4H10OS
Molecular Mass106.0452
SMILESCC(O)C(C)S
InChI KeyMJQWABQELVFQJL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • hydrocarbon derivatives
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • organosulfur compound
  • alkylthiol