| Record Information |
|---|
| HMDB Status | detected |
|---|
| Creation Date | 2024-02-21 00:29:35 UTC |
|---|
| Update Date | 2025-03-21 18:41:14 UTC |
|---|
| HMDB ID | HMDB0247447 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00133146 |
|---|
| Name | 8-Mercaptooctanoic acid |
|---|
| Frequency | 18.9 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H16O2S |
|---|
| Molecular Mass | 176.0871 |
|---|
| SMILES | O=C(O)CCCCCCCS |
|---|
| InChI Key | FYEMIKRWWMYBFG-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | lipids and lipid-like molecules |
|---|
| Class | fatty acyls |
|---|
| Subclass | fatty acids and conjugates |
|---|
| Direct Parent | medium-chain fatty acids |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | alkylthiolscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganosulfur compoundsstraight chain fatty acids |
|---|
| Substituents | aliphatic acyclic compoundcarbonyl groupstraight chain fatty acidcarboxylic acidorganosulfur compoundcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativemedium-chain fatty acidalkylthiolorganooxygen compound |
|---|
