| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 05:02:29 UTC |
|---|
| Update Date | 2025-03-24 14:10:07 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00776395 |
|---|
| Frequency | 1.9 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H14S |
|---|
| Molecular Mass | 130.0816 |
|---|
| SMILES | C=CC[SH]=CCCC |
|---|
| InChI Key | HGIFRQDNAWRYPU-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organosulfur compounds |
|---|
| Class | allyl sulfur compounds |
|---|
| Subclass | allyl sulfur compounds |
|---|
| Direct Parent | allyl sulfur compounds |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | alkylthiolshydrocarbon derivativesthioaldehydes |
|---|
| Substituents | aliphatic acyclic compoundthioaldehydeallyl sulfur compoundhydrocarbon derivativealkylthiol |
|---|
