Dataset
![molecular Image]()
Clenbuterol
Chemical Info
| InChI | InChI=1S/C12H18Cl2N2O/c1-12(2,3)16-6-10(17)7-4-8(13)11(15)9(14)5-7/h4-5,10,16-17H,6,15H2,1-3H3 |
|---|---|
| SMILES | CC(C)(C)NCC(O)c(c1)cc(Cl)c(N)c(Cl)1 |
| InChI Key | STJMRWALKKWQGH-UHFFFAOYSA-N |
| Molecular Formula | C12H18Cl2N2O |
| Exact Mass | 276.080 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by-nc/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA001313 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataCreated | 2024-01-11T22:37:19.484283 |
| MetadataModified | 2025-02-09T20:25:53.880819 |
| MetadataPublished | 2016-01-19 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| PA164745640 | PharmGKB |
| HMDB0015477 | Human Metabolome Database |
| SCHEMBL4722 | SureChEMBL |
| 2783 | PubChem |
| PD009512 | ProbesDrugs |
| LSM-5144 | LINCS |
| 37148-27-9 | ACToR |
| 50499-60-0 | ACToR |
| 50306-03-1 | ACToR |
| 15222099 | PubChem: Thomson Pharma |
| 901664 | eMolecules |
| 26754555 | eMolecules |
| J261.530D | Nikkaji |
| 673 | DrugCentral |
| J19.704A | Nikkaji |
| 27958 | BindingDB |
| CLENBUTEROL HYDROCHLORIDE | rxnorm |
| CLENBUTEROL | rxnorm |
| CLENBUTEROL | clinicaltrials |
| CLENBUTEROL HYDROCHLORIDE | clinicaltrials |
| HORDIE | CCDC |
| SPIROPENT | clinicaltrials |
| XTZ6AXU7KN | FDA SRS |
| DTXSID7022833 | EPA CompTox Dashboard |
| CB2488419 | ChemicalBook |
| DB01407 | DrugBank |
| CHEMBL49080 | ChEMBL |
| 174690 | ChEBI |
| The data in this table is sourced from UniChem at EBI. | |