Dataset
![molecular Image]()
Sulfurol
Chemical Info
| InChI | InChI=1S/C6H9NOS/c1-5-6(2-3-8)9-4-7-5/h4,8H,2-3H2,1H3 |
|---|---|
| SMILES | CC1=C(SC=N1)CCO |
| InChI Key | BKAWJIRCKVUVED-UHFFFAOYSA-N |
| Molecular Formula | C6H9NOS |
| Exact Mass | 143.040 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by-sa/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01074706 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2025-02-09T10:08:52.297419 |
| MetadataModified | 2025-02-09T10:08:52.490374 |
| MetadataPublished | 2024-05-08 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 15412919 | PubChem: Thomson Pharma |
| 1136 | PubChem |
| PD007492 | ProbesDrugs |
| 847870-14-8 | ACToR |
| 137-00-8 | ACToR |
| SCHEMBL259480 | SureChEMBL |
| 3XYV4I47I8 | FDA SRS |
| 2587 | Brenda |
| 20033 | Brenda |
| 5914 | Brenda |
| MTBLC17957 | Metabolights |
| 17957 | Rhea |
| CB6127677 | ChemicalBook |
| HMDB0032985 | Human Metabolome Database |
| 20146176 | NMRShiftDB |
| MCULE-7651382617 | Mcule |
| 486961 | eMolecules |
| DTXSID3044382 | EPA CompTox Dashboard |
| ZINC000000160790 | ZINC |
| 50016817 | BindingDB |
| J5.626J | Nikkaji |
| TZE | PDBe |
| 17957 | ChEBI |
| C04294 | KEGG Ligand |
| DB02969 | DrugBank |
| CHEMBL1236482 | ChEMBL |
| The data in this table is sourced from UniChem at EBI. | |